Genegobio Inc.

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Profile: Genegobio, Inc. is a supplier of active pharmaceutical ingredients. Our products include adefovir dipivoxil, adenosine, adriamycin, alendronate sodium, ambroxol Hcl, amifostine, amikacin sulfate, amlexanox, amlodipine besylate, and amorolfine Hcl.

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• Daptomycin

Synonyms: DAPTOMYCIN, N-decanoyl-L-tryptophyl-L-asparaginyl-N-[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2R)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-ox, N-decanoyl-L-tryptophyl-L-asparaginyl-N-[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2R)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonaazacyclohentriacontan-30-yl]-L-alpha-asparagine

Molecular Formula:	C₇₂H₁₀₁N₁₇O₂₆	Molecular Weight:	1620.670640 [g/mol]
H-Bond Donor:	22	H-Bond Acceptor:	29

InChIKey: DOAKLVKFURWEDJ-RWDRXURGSA-N

• Darunavir

IUPAC Name: [(3R,3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-3-yl] N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate | CAS Registry Number: 206361-99-1
Synonyms: Prezista, Darunavirum, 2idw, 2ien, Darunavir [USAN], TMC-114, Darunavirum [INN-Latin], TMC114, 2f8g, 2hs1, 2hs2, Darunavir (USAN/INN), UIC-94017, TMC 114, AIDS073035, UNII-YO603Y8113, 2f80, 2f81, AIDS-073035, CID213039

Molecular Formula:	C₂₇H₃₇N₃O₇S	Molecular Weight:	547.663580 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: CJBJHOAVZSMMDJ-HEXNFIEUSA-N

• Dasatinib

IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide hydrate | CAS Registry Number: 863127-77-9
Synonyms: Dasatinib hydrate, Dasatinib hydrate (JAN), D06414

Molecular Formula:	C₂₂H₂₈ClN₇O₃S	Molecular Weight:	506.020820 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	9

InChIKey: XHXFZZNHDVTMLI-UHFFFAOYSA-N

• Daunomycin Hydrochloride

IUPAC Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride | CAS Registry Number: 23541-50-6
Synonyms: Cerubidine, Daunoblastin, Daunoblastina, Rubomycin, Ondena, Daunomycin HCL, Cerubidine (TN), Daunomycin chlorohydrate, Daunomycin hydrochloride, Rubidomycin hydrochloride, WP900 hydrochloride, Daunomycin, hydrochloride, DAUNORUBICIN HCL, Ambap1316, RP 13057 hydrochloride, DAUNORUBICIN HYDROCHLORIDE, CCRIS 915, (−)-Daunorubicin, MLS000069508, W4013_SIGMA

Molecular Formula:	C₂₇H₃₀ClNO₁₀	Molecular Weight:	563.980800 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	11

InChIKey: GUGHGUXZJWAIAS-QQYBVWGSSA-N

• Dexamethasone Sodium Phosphate

IUPAC Name: disodium [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate | CAS Registry Number: 2392-39-4
Synonyms: Dalalone, Dexadreson, Neodecadron, Turbinaire, Megacort, Soldesam, Spersadox, Dexagro, Maxidex, Corson, Decdan, Solu-Decadron, dexamethasone, Maxidex Ointment, Decadron, Dexacort, Hexadrol, Dexair, Decadron phosphate, Mixture Name

Molecular Formula:	C₂₂H₂₈FNa₂O₈P	Molecular Weight:	516.404624 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: PLCQGRYPOISRTQ-FCJDYXGNSA-L

• Dexrazoxane

IUPAC Name: 4-[(2S)-1-(3,5-dioxopiperazin-1-yl)propan-2-yl]piperazine-2,6-dione | CAS Registry Number: 24584-09-6
Synonyms: Zinecard, Dextrorazoxane, Cardioxane, Desrazoxane, (+)-dexrazoxane, Zinecard (TN), Razoxane (+)-form, Dexrazoxanum [INN-Latin], Dexrazoxano [INN-Spanish], Razoxane, (S)-Isomer, Razoxanum [INN-Latin], Razoxana [INN-Spanish], ICRF-187, Dexrazoxane (USAN/INN), ADR 529, Dexrazoxane [USAN:BAN:INN], Soluble ICRF (L-isosomer), HSDB 7319, ICRF 187, CHEBI:50223

Molecular Formula:	C₁₁H₁₆N₄O₄	Molecular Weight:	268.269140 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: BMKDZUISNHGIBY-ZETCQYMHSA-N

• Diosmin

IUPAC Name: 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6-iodo-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

Molecular Formula:	C₂₈H₃₁IO₁₅	Molecular Weight:	734.441210 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	15

InChIKey: ODHZOEUTFCPQMO-MBXQFJRTSA-N

• Dipyridamole

IUPAC Name: 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol | CAS Registry Number: 58-32-2
Synonyms: dipyridamole, Dipyridamine, Dipyridamol, Persantine, Dipyudamine, Persantin, Curantyl, Kurantil, Stimolcardio, Cardioflux, Stenocardil, Cardoxin, Anginal, Apricor, Coribon, Corosan, Coroxin, Stenocardiol, Chilcolan, Dipyridan

Molecular Formula:	C₂₄H₄₀N₈O₄	Molecular Weight:	504.625600 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	12

InChIKey: IZEKFCXSFNUWAM-UHFFFAOYSA-N

• Docetaxel

Synonyms: docetaxel, Taxotere, Docetaxol, Docetaxel anhydrous, nchembio853-comp8, Docetaxel, Trihydrate, nchembio.2007.34-comp7, 01885_FLUKA, XRP-6976L, ANX-514, SDP-014, DB01248, NSC-628503, RP-56976, SL-00678, C11231, TXL, (2alpha,5beta,7beta,10beta,13alpha)-4-(acetyloxy)-13-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-3-phenylpropanoyl}oxy)-1,7,10-trihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl (aR,bS)-b-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxybenzenepropanoate

Molecular Formula:	C₄₃H₅₃NO₁₄	Molecular Weight:	807.879220 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	14

InChIKey: ZDZOTLJHXYCWBA-VCVYQWHSSA-N

• Docetaxel Trihydrate

Synonyms: docetaxel, Taxotere, Docetaxel hydrate, Taxotere (TN), Docetaxel (USAN), Docetaxel hydrate (JAN), Docetaxel [USAN:INN:BAN], CID148123, RP 56976, D02165, Benzenepropanoic acid, beta-(((1,1-dimethylethoxy)carbonyl)amino)-alpha-hydroxy-, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,1313-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca(3,4)benz(1,2-b)oxet-9-yl ester, trihydrate, (alphaR,betaS)-, Benzenepropanoic acid, beta-(((1,1-dimethylethoxy)carbonyl)amino)-alpha-hydroxy-, 12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca(3,4)benz(1,2-b)oxet-9-yl ester trihydrate, (2aR-(2aalpha,4beta,4abeta,6beta,9alpha(alphaR*,betaS),11alpha,12alpha,12aalpha,12balpha))-

Molecular Formula:	C₄₃H₅₉NO₁₇	Molecular Weight:	861.925060 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	17

InChIKey: XCDIRYDKECHIPE-QHEQPUDQSA-N

• Dolasetron

IUPAC Name: 2-[4-(thiophene-2-carbonyl)phenyl]propanoic acid | CAS Registry Number: 40828-46-4
Synonyms: suprofen, Profenal, Maldocil, Suprol, Sutoprofen, Masterfen, Suprocil, Profenal (TN), Prestwick_131, Suprofene [INN-French], Suprofenum [INN-Latin], p-2-Thenoylhydratropic acid, Spectrum_001157, Prestwick0_000816, Prestwick1_000816, Prestwick2_000816, Prestwick3_000816, Spectrum2_001430, Spectrum3_000928, Spectrum4_001027

Molecular Formula:	C₁₄H₁₂O₃S	Molecular Weight:	260.308280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: MDKGKXOCJGEUJW-UHFFFAOYSA-N

• Doripenem

IUPAC Name: (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-3-[(3S,5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid | CAS Registry Number: 148016-81-3
Synonyms: Doripenem (USAN/INN), Doripenem [USAN:INN], NCGC00167510-01, D03895, S 4661, S-4661, 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-(((3S,5S)-5-(((aminosulfonyl)amino)methyl)-3-pyrrolidinyl)thio)-6-((1R)-1-hydroxyethyl)-4-methyl-7-oxo-, (4R,5S,6S)-, 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((5-(((aminosulfonyl)amino)methyl)-3-pyrrolidinyl)thio)-6-(1-hydroxyethyl)-4-methyl-7-oxo-, (4R-(3(3S*,5S*),4alpha,5beta,6beta(R*)))-

Molecular Formula:	C₁₅H₂₄N₄O₆S₂	Molecular Weight:	420.504260 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	9

InChIKey: AVAACINZEOAHHE-VFZPANTDSA-N

• Doxazosin Mesylate

IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-2-yl)methanone; methanesulfonic acid | CAS Registry Number: 77883-43-3
Synonyms: Doxazosin mesylate, Cardura, Cardenalin, Progandol, Tensiobas, Cardular, Carduran, Dedralen, Doxazomerck, Prostadilat, Tonocardin, Cardoral, Cardoxan, Diblocin, Doxolbran, Kaltensif, Normathen, Supressin, Alfadil, Doksura

Molecular Formula:	C₂₄H₂₉N₅O₈S	Molecular Weight:	547.580760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	12

InChIKey: VJECBOKJABCYMF-UHFFFAOYSA-N

• Doxercalciferol

IUPAC Name: (1S,3S,4E)-4-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-6-methylidenecyclohexane-1,3-diol | CAS Registry Number: 54573-75-0
Synonyms: Hectorol, doxacalciferol, 1alpha-OHD2, 1-Hydroxyergocalciferol, 1alpha(OH)2D2, 1alpha-hydroxyvitamin D2, 1-alpha-Hydroxyvitamin D2, 1alpha-Hydroxyergocalciferol, 1 alpha-hydroxyergocalciferol, TSA 840, BRN 4716774, Draxis brand of 1 alpha-hydroxyergocalciferol, Bone Care brand of 1 alpha-hydroxyergocalciferol, C042533, 9,10-Secoergosta-5,7,10(19),22-tetraene-1,3-diol, (1-alpha,3-beta,5Z,7E,22E)-, 125285-48-5, 87649-67-0

Molecular Formula:	C₂₈H₄₄O₂	Molecular Weight:	412.647760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: DAQLPCKTVQWADC-MEVDWTRGSA-N

• DOXORUBICIN HCL (CAS: 253-40-9)

• Efavirenz

IUPAC Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one | CAS Registry Number: 154598-52-4
Synonyms: efavirenz, Sustiva, Stocrin, 1ikv, 1ikw, Strocin (TM), Sustiva (TM), Sustiva (TN), efavirenz, (S)-isomer, Efavirenz (JAN/INN), C14H9ClF3NO2, DMP-266, HSDB 7163, MLS000759465, MLS001424087, DMP 266, Met-SDF-1.beta. & Efavirenz, AIDS032934, AIDS106821, AIDS-032934

Molecular Formula:	C₁₄H₉ClF₃NO₂	Molecular Weight:	315.674970 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: XPOQHMRABVBWPR-ZDUSSCGKSA-N

• Enoxacin

IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid | CAS Registry Number: 74011-58-8
Synonyms: enoxacin, Penetrex, Comprecin, Flumark, Bactidan, Enoram, Enoxor, Almitil, Enoxin, Enoxacine [French], Enoxacinum [Latin], Enoxacino [Spanish], Penetrex (TN), Prestwick_708, Enoxacin Sesquihydrate, Sesquihydrate, Enoxacin, Spectrum_001539, Enoxacin (USAN/INN), Prestwick0_000353, Prestwick1_000353

Molecular Formula:	C₁₅H₁₇FN₄O₃	Molecular Weight:	320.318883 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	8

InChIKey: IDYZIJYBMGIQMJ-UHFFFAOYSA-N

• Entecavir Hydrate

IUPAC Name: 2-amino-9-[(3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-3H-purin-6-one hydrate | CAS Registry Number: 209216-23-9
Synonyms: Entecavir, Baraclude, Entecavir [USAN:INN], CID170342, SQ 34676, BMS 200475-01, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-((1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-, monohydrate

Molecular Formula:	C₁₂H₁₇N₅O₄	Molecular Weight:	295.294480 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	7

InChIKey: YXPVEXCTPGULBZ-JBDQBEHPSA-N

• Epirubicin HCL

IUPAC Name: (7S,9S)-7-[(2R,4S,5R,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride | CAS Registry Number: 56390-09-1
Synonyms: Ellence, Pharmorubicin, Farmorubicin, Epirubicin hydrochloride, Epidoxorubicin, Farmorubicina, Pidorubicin, 4'-epi-Adriamycin, Ellence (TN), 4'-epi-Doxorubicin, Ambap5427, E-ADM, Epidoxorubicin hydrochloride, 4'-epi-DX, CCRIS 4477, 4'-Epidoxorubicin hydrochloride, 4'-epi-Adriamycin hydrochloride, MLS001401404, IMI-28, EINECS 260-145-2

Molecular Formula:	C₂₇H₃₀ClNO₁₁	Molecular Weight:	579.980200 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	12

InChIKey: MWWSFMDVAYGXBV-FGBSZODSSA-N

• Erlotinib

IUPAC Name: N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine | CAS Registry Number: 183321-74-6
Synonyms: Tarceva, erlotinib HCl, Erlotinib [INN], Erlotinib(Tarceva), nchembio866-comp3, OSI-774, STOCK6S-52681, CID176870, DB00530, NCGC00164574-01, BCB03_000783, CP 358774, CP-358774, LS-184395, CP 358,774, CP-358,774, K00241, C400278, N-(3-Ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine, 4-Quinazolinamine, N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)-

Molecular Formula:	C₂₂H₂₃N₃O₄	Molecular Weight:	393.435720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: AAKJLRGGTJKAMG-UHFFFAOYSA-N

• Erlotinib Hcl

IUPAC Name: 2-[4-(3-ethynylanilino)-7-(2-hydroxyethoxy)quinazolin-6-yl]oxyethanol | CAS Registry Number: 183321-84-8
Synonyms: 4-[(3-Ethynylphenyl)amino]-6,7-bis(2-hydroxyethoxy)quinazoline, Erlotinib metabolite, O-Didesmethylerlotinib, AGN-PC-00S2OQ, CTK4D8462, ZINC22057163, AKOS015907687, AG-E-33052, KB-188465, FT-0658083, ST51054786, A812765, I14-2708, 2-[[4-(3-ethynylanilino)-7-(2-hydroxyethoxy)-6-quinazolinyl]oxy]ethanol, 2-[4-(3-ethynylanilino)-7-(2-hydroxyethoxy)quinazolin-6-yl]oxyethanol, 2-[4-[(3-ethynylphenyl)amino]-7-(2-hydroxyethyloxy)quinazolin-6-yl]oxyethanol, Ethanol,2-[[4-[(3-ethynylphenyl)amino]-6-(2-hydroxyethoxy)-7-quinazolinyl]oxy]-, Ethanol,2,2'-[[4-[(3-ethynylphenyl)amino]-6,7-quinazolinediyl]bis(oxy)]bis- (9CI);CP373943;2,2'-[{4-[(3-Ethynylphenyl)amino]-6,7-quinazolinediyl}bis(oxy)]diethanol;

Molecular Formula:	C₂₀H₁₉N₃O₄	Molecular Weight:	365.382560 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: YWSAEKIQJPQSDJ-UHFFFAOYSA-N

• Ertapenem

IUPAC Name: (4R,5S,6S)-3-[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid | CAS Registry Number: 153832-46-3
Synonyms: Ertapenem [INN], CID150610, DB00303, LS-187017, LS-187767, 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-(((3S,5S)-5-(((3-carboxyphenyl)amino)carbonyl)-3-pyrrolidinyl)thio)-6-((1R)-1-hydroxyethyl-4-methyl-7-oxo-, (4R,5S,6S)-, 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((5-(((3-carboxyphenyl)amino)carbonyl)-3-pyrrolidinyl)thio)-6-(1-hydroxyethyl)-4-methyl-7-oxo-, (4R-(3(3S*,5S*),4alpha,5beta,6beta(R*)))-, (4R,5S,6S)-3-[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Molecular Formula:	C₂₂H₂₅N₃O₇S	Molecular Weight:	475.514800 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	8

InChIKey: JUZNIMUFDBIJCM-ANEDZVCMSA-N

• Erythromycin

IUPAC Name: (2R,3R,4S,5R,8R,9S,10S,11R,12R,14R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-ethyl-3,4,12-trihydroxy-9-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-6-oxacyclotetradecane-1,7-dione | CAS Registry Number: 114-07-8
Synonyms: erythromycin, Erythromycin A, Abomacetin, Erymax, Emgel, erythro, Erythrocin, Ilotycin, Staticin, Eryacne, Erygel, Akne-Mycin, Erythromycin oxime, E-Mycin, Erythrocin stearate, T-Stat, Staticin (TN), Akne-mycin (TN), Prestwick_205, Erygel (TN)

Molecular Formula:	C₃₇H₆₇NO₁₃	Molecular Weight:	733.926780 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	14

InChIKey: ULGZDMOVFRHVEP-RWJQBGPGSA-N

• Erythromycin Estolate

IUPAC Name: [(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(1R,2R,4R,6R,7R,8S,9R,12R,13S,14S)-9-ethyl-2,7,8-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,6,8,12,14-hexamethyl-5,11-dioxo-10-oxacyclotetradec-1-yl]oxy]-6-methyloxan-3-yl] propanoate; dodecyl hydrogen sulfate | CAS Registry Number: 3521-62-8
Synonyms: Ilosone, Erythromycin estorate, Ilosone (TN), PELS, ERYTHROMYCIN ESTOLATE, Erythromycin estolate (USP), Erythromycin estorate (JAN), SPECTRUM1501176, CHEBI:4846, Propionylerythromycin lauryl sulfate, LMPK01000019, erythromycin propionate lauryl sulfate, monopropionylerythromycin laurylsulfate, NCGC00180881-01, Lauryl sulfate propionyl erythromycin ester, C08031, D00851, Erythromycin 2'-propionate dodecyl sulfate (salt), Erythromycin propionate, compound with dodecyl sulfate, propionic acid, 2'-ester with erythromycin, dodecyl sulfate

Molecular Formula:	C₅₂H₉₇NO₁₈S	Molecular Weight:	1056.387480 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	19

InChIKey: AWMFUEJKWXESNL-JZBHMOKNSA-N

• Erythromycin Ethylsuccinate

IUPAC Name: 1-O-[(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(1R,2R,4R,6R,7R,8S,9R,12R,13S,14S)-9-ethyl-2,7,8-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,6,8,12,14-hexamethyl-5,11-dioxo-10-oxacyclotetradec-1-yl]oxy]-6-methyloxan-3-yl] 4-O-ethyl butanedioate | CAS Registry Number: 1264-62-6
Synonyms: Monomycin, EryPed, Pediamycin, erythromycin ethylsuccinate, Wyamycin E, Erythroped, Pediazole, Erythrocin W, Mixture Name, E-Mycin E, E-Mycin-E, Eryped (TN), ERYZOLE, Erythrocin W (TN), ERY-PED, Spectrum_001046, Spectrum2_000983, Spectrum3_000419, Spectrum4_000536, Spectrum5_000668

Molecular Formula:	C₄₃H₇₅NO₁₆	Molecular Weight:	862.052700 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	17

InChIKey: NSYZCCDSJNWWJL-YXOIYICCSA-N

• Ethinyl Estradiol

IUPAC Name: (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol | CAS Registry Number: 57-63-6
Synonyms: ethinyl estradiol, Ethynylestradiol, Ethinyloestradiol, Estinyl, Etinoestryl, Etistradiol, Ethinoral, Eticyclin, Eticyclol, Etinestrol, Etinestryl, Follicoral, Ginestrene, Novestrol, Orestralyn, Spanestrin, Amenoron, Dyloform, Estorals, Feminone

Molecular Formula:	C₂₀H₂₄O₂	Molecular Weight:	296.403360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: BFPYWIDHMRZLRN-SLHNCBLASA-N

• Etidronate Disodium

IUPAC Name: disodium hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]ethyl]phosphinate | CAS Registry Number: 7414-83-7
Synonyms: Didronel, Diphos, Etidronate disodium, Didronel R, Sodium etidronate, Sodium ethidronate, Sodium ethydronate, Disodium etidronate, Disodium ethydronate, Didronel (TN), Etidronic acid disodium, Prestwick_1061, Ambap796, Etidronsaeure dinatriumsalz, C3H8O6P2.2Na, Etidronic acid, disodium salt, Etidronate Disodium [USAN:JAN], Disodium ethanol-1,1-diphosphonate, EINECS 231-025-7, Etidronate disodium (JP15/USP)

Molecular Formula:	C₂H₆Na₂O₇P₂	Molecular Weight:	249.991902 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: GWBBVOVXJZATQQ-UHFFFAOYSA-L

• Etoposide

IUPAC Name: (5R,5aR,8aR,9S)-9-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-6-one | CAS Registry Number: 33419-42-0
Synonyms: etoposide, VePesid, Lastet, trans-Etoposide, Zuyeyidal, Toposar, (-)-Etoposide, Vepesid J, Vepeside, Eposide, Etopol, Etosid, Etoposide (VP16), Etoposidum [INN-Latin], EPEG, Etoposido [INN-Spanish], VP 16 (pharmaceutical), Ambap1061, Etopophos (phosphate salt), VePESID (TN)

Molecular Formula:	C₂₉H₃₂O₁₃	Molecular Weight:	588.556580 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	13

InChIKey: VJJPUSNTGOMMGY-MRVIYFEKSA-N

• Etoposide phosphate

IUPAC Name: [4-[(5R,5aR,8aR,9S)-9-[(7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-6-oxo-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]-2,6-dimethoxyphenyl] dihydrogen phosphate | CAS Registry Number: 117091-64-2
Synonyms: Etopofos, Etopophos, Etophos, ETOPOSIDE PHOSPHATE, Etoposide phosphate [USAN], Etopophos Preservative Free, BMY 40481, BMY-40481, C29H32O13, BMY-40481-30, LS-172346, 4'-Demethylepipodophyllotoxin 9-(4,6-O-(R)-ethylidene-beta-D-glucopyranoside), 4'-(dihydrogen phosphate), Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 5-(3,5-dimethoxy-4-(phosphonooxy)phenyl)-9-((4,6-O-ethylidene-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-, (5R-(5alpha,5abeta,8aalpha,9beta(R*)))-

Molecular Formula:	C₂₉H₃₃O₁₆P	Molecular Weight:	668.536481 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	16

InChIKey: LIQODXNTTZAGID-GDAYZDJCSA-N

• Exemestane

IUPAC Name: (8R,9S,10R,13S,14S)-10,13-dimethyl-6-methylidene-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 107868-30-4
Synonyms: EXEMESTANE, Aromasin, Aromasil, Aromasine, Nikidess, Aromasin (TN), Exemestanum [INN-Latin], Exemestano [INN-Spanish], Ambap3895, Curator_000009, Fce 24304, Exemestane [USAN:INN:BAN], Exemestane (JAN/USP/INN), Pharmacia brand of exemestane, MLS000759419, MLS001424062, FCE-24304, HSDB 7463, Pharmacia Spain brand of exemestane, C20H24O2

Molecular Formula:	C₂₀H₂₄O₂	Molecular Weight:	296.403360 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: BFYIZQONLCFLEV-DAELLWKTSA-N

• Famciclovir

IUPAC Name: [2-(acetyloxymethyl)-4-(2-aminopurin-9-yl)butyl] acetate | CAS Registry Number: 104227-87-4
Synonyms: famciclovir, Famvir, Oravir, Famvir (TN), Spectrum_000466, Famciclovirum [INN-Latin], Anti-Farnesyl Rabbit pAb, Spectrum2_001101, Spectrum3_001675, Spectrum4_000611, Spectrum5_001548, Famciclovir [USAN:BAN:INN], BSPBio_003489, KBioGR_001162, KBioSS_000946, MLS000759505, MLS001424115, SPECTRUM1505201, SPBio_001202, BRL 42810

Molecular Formula:	C₁₄H₁₉N₅O₄	Molecular Weight:	321.331760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	9

InChIKey: GGXKWVWZWMLJEH-UHFFFAOYSA-N

• Faropenem Sodium

IUPAC Name: disodium;(5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2R)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate;pentahydrate | CAS Registry Number: 158365-51-6
Synonyms: faropenem sodium hemipentahydrate, UNII-N39L5ALZ3M, 122547-49-3

Molecular Formula:	C₂₄H₃₈N₂Na₂O₁₅S₂	Molecular Weight:	704.672459 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	17

InChIKey: MOGICMVNWAUWMK-HIXRZVNASA-L

• Fenofibrate

IUPAC Name: propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate | CAS Registry Number: 49562-28-9
Synonyms: fenofibrate, Lipantil, Tricor, Procetofen, Lipanthyl, Triglide, Lipidil, Secalip, Antara, Finofibrate, Proctofene, Lipoclar, Fenogal, Lipirex, Sedufen, Phenofibrate, Elasterate, Procetofene, Protolipan, Elasterin

Molecular Formula:	C₂₀H₂₁ClO₄	Molecular Weight:	360.831340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: YMTINGFKWWXKFG-UHFFFAOYSA-N

• Floxuridine (CAS: 770-32-4)

• Fludarabine

IUPAC Name: [(2R,3S,4S,5R)-5-(6-amino-2-fluoropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | CAS Registry Number: 75607-67-9
Synonyms: fludara, fludarabine phosphate, Fludura, Beneflur, FAMP, FaraAMP, fluoro-ara-AMP, Fludarabine monophosphate, 2-Fluoro-ARA AMP, Fludara (TN), 2-Fluoro-ara-AMP, F-ara-AMP, Ambap1079, Fludarabine 5'-monophosphate, 2-F-ara-AMP, C10H13FN5O7P, Fludarabine phosphate [USAN:BAN], NSC-312887, Fludarabine phosphate (JAN/USP), SHT-586

Molecular Formula:	C₁₀H₁₃FN₅O₇P	Molecular Weight:	365.211684 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	13

InChIKey: GIUYCYHIANZCFB-FJFJXFQQSA-N

• Fluticasone Propionate

IUPAC Name: [(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate | CAS Registry Number: 80474-14-2
Synonyms: Cutivate, Flonase, Flovent, Flixonase, Flixotide, Flusonal, Fluspiral, Flunase, Flutide, atemur, Flutivate, Fluxonal, Inalacor, Rinosone, Trialona, Asmatil, Axotide, Brethal, Fluinol, Skyron

Molecular Formula:	C₂₅H₃₁F₃O₅S	Molecular Weight:	500.570850 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: WMWTYOKRWGGJOA-CENSZEJFSA-N

• Fluvastatin Sodium

IUPAC Name: sodium (E,3S,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoate | CAS Registry Number: 93957-55-2
Synonyms: Lescol, Lescol (TN), FLUVASTATIN SODIUM, Fluvastatin sodium (JAN/USAN), D00892

Molecular Formula:	C₂₄H₂₅FNNaO₄	Molecular Weight:	433.447773 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: ZGGHKIMDNBDHJB-VASWWXHQSA-M

• Fosfomycin Sodium

IUPAC Name: tetrasodium [4-[(E)-4-(4-phosphonatooxyphenyl)hex-3-en-3-yl]phenyl] phosphate | CAS Registry Number: 4719-75-9
Synonyms: Honvol, Honvan tetrasodium, Fosfestrol tetrasodium, Tetrasodium fosfestrol, Fosfestrol tetrasodium salt, Stilbestrol diphosphate sodium, C18H18O8P2.4Na, EINECS 225-209-6, Sodium diethylstilbesterol diphosphate, Diethylstilbestrol diphosphate tetrasodium, Diethylstilbestrol phosphate tetrasodium, Tetrasodium diethylstilbestrol phosphate, CID3034148, fosfestrol, tetrasodium salt, (E)-isomer, Diethylstilbestrol 4,4'-di(disodium phosphate), LS-146819, 4,4'-Dihydroxy-alpha,alpha'-diethyl-stilben-diphosphate tetrasodium, Tetrasodium (E)-4,4'-(1,2-diethylethylene)diphenyl bis(phosphate), 4,4'-Stilbenediol, alpha,alpha'-diethyl-, bis(dihydrogen phosphate), tetrasodium salt (E)-, 4,4'-Stilbenediol, alpha,alpha'-diethyl-, bis(dihydrogen phosphate), tetrasodium salt, (E)-

Molecular Formula:	C₁₈H₁₈Na₄O₈P₂	Molecular Weight:	516.237322 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	8

InChIKey: XGZAXRQNRRXUMY-MJCKVQKWSA-J

• Fosinopril

IUPAC Name: (2S,4S)-4-cyclohexyl-1-[2-[(2-methyl-1-propanoyloxypropoxy)-(4-phenylbutyl)phosphoryl]acetyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 98048-97-6
Synonyms: fosinopril, FOSINOPRIL SODIUM, CID55891, DB00492, LS-187220, C07016, (2S,4S)-4-cyclohexyl-1-[2-[(2-methyl-1-propanoyloxypropoxy)-(4-phenylbutyl)phosphoryl]acetyl]pyrrolidine-2-carboxylic acid, (4S)-4-cyclohexyl-1-{[{[2-methyl-1-(propanoyloxy)propyl]oxy}(4-phenylbutyl)phosphoryl]acetyl}-L-proline, L-Proline, 4-cyclohexyl-1-(((2-methyl-1-(1-oxopropoxy)propoxy)(4-phenylbutyl)phosphinyl)acetyl)-, (1(S*(R*)),2alpha,4beta)-, L-Proline, 4-cyclohexyl-1-(((2-methyl-1-(1-oxopropoxy)propoxy)(4-phenylbutyl)phosphinyl)acetyl)-, (2alpha,4beta)-

Molecular Formula:	C₃₀H₄₆NO₇P	Molecular Weight:	563.662501 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: BIDNLKIUORFRQP-FKDWWROVSA-N

• Ganciclovir

IUPAC Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one | CAS Registry Number: 82410-32-0
Synonyms: ganciclovir, Cytovene, Vitrasert, Gancyclovir, Hydroxyacyclovir, Citovirax, Cymevene, DHPG, Cymevan, Cymeven, Virgan, HHEMG, Vitrasert (TN), Biolf 62, Cytovene (TN), Ganciclovirum [Latin], nchembio.87-comp3, Prestwick_1068, GANCICLOVIR SODIUM, 2'-Nor-2'-deoxyguanosine

Molecular Formula:	C₉H₁₃N₅O₄	Molecular Weight:	255.230620 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: IRSCQMHQWWYFCW-UHFFFAOYSA-N

• Gefitinib

IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4-amine | CAS Registry Number: 184475-35-2
Synonyms: Iressa, Irressat, Gefitini; Iressa, Gefitinib [USAN], Iressa (TN), nchembio866-comp14, nchembio.117-comp18, ZD1839, KBioSS_002241, Gefitinib (JAN/USAN/INN), ZD 1839, CCRIS 9011, STOCK6S-52331, CHEBI:49668, ZD-1839, CID123631, NSC715055, DB00317, NCGC00159455-02, NCGC00159455-03

Molecular Formula:	C₂₂H₂₄ClFN₄O₃	Molecular Weight:	446.902363 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: XGALLCVXEZPNRQ-UHFFFAOYSA-N

• Gemcitabine HCL

IUPAC Name: 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one hydrochloride | CAS Registry Number: 122111-03-9
Synonyms: Gemzar, Gemzar (TN), GEMCITABINE HYDROCHLORIDE, Ambap6387, LY188011 hydrochloride, Gemcitabine HCL (Gemzar), C9H11F2N3O4.HCl, Gemcitabine hydrochloride [USAN], Gemcitabine hydrochloride (JAN/USAN), 2',2'-Difluorodeoxycytidine monohydrochloride, CPD000469146, LS-59069, SAM001246550, TL8000589, 2'-Deoxy-2',2'-difluorocytidine monohydrochloride, D01155, Cytidine, 2'-deoxy-2',2'-difluoro-, monohydrochloride, 2'-Deoxy-2',2'-difluorocytidine monohydrochloride (beta-isomer), 103882-84-4, 95058-81-4

Molecular Formula:	C₉H₁₂ClF₂N₃O₄	Molecular Weight:	299.659086 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: OKKDEIYWILRZIA-OSZBKLCCSA-N

• Gimeracil

IUPAC Name: 5-chloro-2-hydroxy-1H-pyridin-4-one | CAS Registry Number: 103766-25-2
Synonyms: Cdhp compound, Gimeracil (JAN/INN), 5-Chloro-2,4-dihydroxypyridine, CID3472, 5-Chloro-4-hydroxy-2(1H)-pyridinone, NCGC00181011-01, 2(1H)-Pyridinone, 5-chloro-4-hydroxy-, LS-187692, D01846

Molecular Formula:	C₅H₄ClNO₂	Molecular Weight:	145.543760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: ZPLQIPFOCGIIHV-UHFFFAOYSA-N

• Granisetron Base

IUPAC Name: 1-methyl-N-[(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-7-yl]indazole-3-carboxamide | CAS Registry Number: 109889-09-0
Synonyms: granisetron, Granisetron (USAN/INN), CID5284566, C07023, D04370, 1-methyl-N-[(3-endo)-9-methyl-9-azabicyclo[3.3.1]non-3-yl]-1H-indazole-3-carboxamide

Molecular Formula:	C₁₈H₂₄N₄O	Molecular Weight:	312.409360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MFWNKCLOYSRHCJ-AGUYFDCRSA-N

• Heparin Sodium

IUPAC Name: (4S,6R)-6-[(2R,4R)-4,6-dihydroxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3,4-dihydroxy-5-sulfonatooxyoxane-2-carboxylate | CAS Registry Number: 9041-08-1
Synonyms: Nadroparin, Nadroparine, Clivarin, Liquaemin, Reviparin, Ardeparin sodium, Reviparin sodium, Dalteparin sodium, CY 216, Kabi 2165, Multiparin, Novoheparin, Parnaparin, Parvoparin, Sandoparin, Sublingula, Tinzaparin, Ardeparin, Heparina, Heparine

Molecular Formula:	C₁₂H₁₇NO₂₀S₃-₄	Molecular Weight:	591.453080 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	21

InChIKey: OHJKXVLJWUPWQG-IUYNYSEKSA-J

• Hydrochlorothiazide

IUPAC Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide | CAS Registry Number: 58-93-5
Synonyms: hydrochlorothiazide, Esidrix, Hypothiazide, Esidrex, Oretic, Dichlotiazid, Hidrotiazida, Hydrodiuretic, Hydrosaluric, Servithiazid, Dichlotride, Diclotride, Hypothiazid, Idrotiazide, Megadiuril, Aquarills, Disalunil, Newtolide, Thiuretic, Aquarius

Molecular Formula:	C₇H₈ClN₃O₄S₂	Molecular Weight:	297.739120 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: JZUFKLXOESDKRF-UHFFFAOYSA-N

• Hydroxyurea

IUPAC Name: hydroxyurea | CAS Registry Number: 127-07-1
Synonyms: hydroxyurea, Hydroxycarbamide, Hydrea, N-Hydroxyurea, Carbamoyl oxime, Litalir, Oxyurea, Droxia, Hydroxycarbamine, Onco-carbide, Biosupressin, Hydurea, Hidrix, Hydura, Hydroxicarbamidum, Urea, hydroxy-, Carbamyl hydroxamate, Carbamohydroxamic acid, Carbamohydroximic acid, Hydroxycarbamid

Molecular Formula:	CH₄N₂O₂	Molecular Weight:	76.054660 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	2

InChIKey: VSNHCAURESNICA-UHFFFAOYSA-N

• Idarubicin HCL

IUPAC Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride | CAS Registry Number: 57852-57-0
Synonyms: Idarubicin Hcl, Idamycin, Idamycin (TN), idarubicin hydrochloride, Ambap2475, MLS001401448, Idarubicin hydrochloride (JP15/USP), CPD000466355, SAM001246676, SMR000466355, D01747

Molecular Formula:	C₂₆H₂₈ClNO₉	Molecular Weight:	533.954820 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	10

InChIKey: JVHPTYWUBOQMBP-RVFAQHLVSA-N

• Ifosfamide

IUPAC Name: N,2-bis(2-chloroethyl)-1-oxo-6-oxa-2-aza-1$l^{5}-phosphacyclohexan-1-amine | CAS Registry Number: 3778-73-2
Synonyms: ifosfamide, Isophosphamide, Iphosphamide, Isofosfamide, Iphosphamid, Ifosfamid, I-Phosphamide, Isoendoxan, Mitoxana, Naxamide, Cyfos, Holoxan, Ifex, Ifsofamide, Iso-Endoxan, Ifosamide, Holoxan 1000, Iso Endoxan, Iphosphamid(e), Ifex/Mesnex Kit

Molecular Formula:	C₇H₁₅Cl₂N₂O₂P	Molecular Weight:	261.085961 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: HOMGKSMUEGBAAB-UHFFFAOYSA-N

• Imatinib Mesylate

IUPAC Name: methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide | CAS Registry Number: 220127-57-1
Synonyms: Imatinib mesylate, Gleevec, Glivec, Imatinib mesilate, Gleevac, Gleevec (TN), Glivec (TN), Imatinib Methansulfonate, imatinib methanesulfonate, Imatinib mesilate (JAN), sti-571, HSDB 7142, MLS001401456, STI571, CHEBI:31690, STI 571, CGP 57148B, GGP-57148B, CGP 53715, CGP-57148

Molecular Formula:	C₃₀H₃₅N₇O₄S	Molecular Weight:	589.708400 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	10

InChIKey: YLMAHDNUQAMNNX-UHFFFAOYSA-N