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• DL-Homocystine

IUPAC Name: 2-amino-4-(3-amino-4-hydroxy-4-oxobutyl)disulfanylbutanoic acid | CAS Registry Number: 870-93-9
Synonyms: HOMOCYSTINE, Oxidized DL-Homocysteine, HOMOCYSTINE, DL-, H0501_SIGMA, NSC11337, 53550_FLUKA, CHEBI:17485, NSC226570, AIDS159849, 4,4'-Dithiobis(2-aminobutyric acid), DL-4,4'-Dithiobis(2-aminobutyric acid), AIDS-159849, NSC43122, EINECS 207-323-8, EINECS 212-803-5, NSC 11337, NSC206271, 4,4'-Dithiobis(2-aminobutyric) acid, 4,4'-Dithiobis[2-aminobutyric acid], NSC 226570

Molecular Formula:	C₈H₁₆N₂O₄S₂	Molecular Weight:	268.353640 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: ZTVZLYBCZNMWCF-UHFFFAOYSA-N

• DL-Leu-DL-Tyr

IUPAC Name: (2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid | CAS Registry Number: 19659-00-8
Synonyms: L-LEUCYL-L-TYROSINE, Leucyltyrosine, CHEMBL56099, CHEBI:73591, 968-21-8, (S)-2-((S)-2-Amino-4-methylpentanamido)-3-(4-hydroxyphenyl)propanoic acid, Tyrosine, leucyl-, H-Leu-Tyr-OH, L-Leu-L-Tyr, N-L-Leucyl-L-tyrosine, SureCN2474675, AC1L2E15, CTK0H2293, MolPort-006-112-726, EINECS 213-527-8, ANW-40836, AR-1J3300, AKOS010367110, AKOS015853930, AG-J-66655

Molecular Formula:	C₁₅H₂₂N₂O₄	Molecular Weight:	294.346180 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: LHSGPCFBGJHPCY-STQMWFEESA-N

• DL-Malic acid dimethyl ester

IUPAC Name: dimethyl 2-hydroxybutanedioate | CAS Registry Number: 38115-87-6
Synonyms: Dimethyl malate, Dimethyl dl-malate, DimethylL-(-)-Malate, Malic acid, dimethyl ester, dimethyl 2-hydroxybutanedioate, DL-Malic Acid Dimethyl Ester, AG-F-34255, Butanedioic acid, hydroxy-, dimethyl ester, dimethyl 2-oxidanylbutanedioate, 2-Hydroxybutanedioic acid dimethyl ester, 1587-15-1, Dimethy DL(-)-Malate, AC1Q43ZX, KSC495A1T, DL-Apple Acid Dimethyl Ester, AC1L203S, Jsp006689, CTK3J5019, YSEKNCXYRGKTBJ-UHFFFAOYSA-, EINECS 216-448-7

Molecular Formula:	C₆H₁₀O₅	Molecular Weight:	162.140600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: YSEKNCXYRGKTBJ-UHFFFAOYSA-N

• DL-Theanine

IUPAC Name: 2-amino-5-(ethylamino)-5-oxopentanoic acid | CAS Registry Number: 34271-54-0
Synonyms: 2-amino-5-(ethylamino)-5-oxopentanoic acid, 2-amino-4-(ethylcarbamoyl)butanoic acid, n-ethylglutamine, NSC21308, ACMC-209hix, L-Theanine (synthetic), AC1Q5OPS, L-Theanine, 99% 1g, SCHEMBL290430, AC1L5G75, CTK6F1961, MolPort-004-964-358, NSC-21308, AKOS006230087, AM82647, AN-5350, L-Theanine (Ngamma-ethyl-L-glutamine), TRA0127721, NCGC00095702-01, AC-23977

Molecular Formula:	C₇H₁₄N₂O₃	Molecular Weight:	174.200 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: DATAGRPVKZEWHA-UHFFFAOYSA-N

• DL-VALINE,N-(2-CHLORO-4-(TRIFLUORO-METHYL)PHENYL)-,CYANO(3-PHENOXY-PHENYL)METHYL ESTER

IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoate | CAS Registry Number: 69409-94-5
Synonyms: FLUVALINATE, Apistan, Klartan, Minadox, Kartan, Mavrik, Mavrik aquaflow, Tau-fluvalinate, Mavrik HR, Mavrik 2E, Mavrik 25EC, SPUR, Fluvalinate [ANSI], Caswell No. 934, Spur 22EW, HSDB 6659, CHEBI:5135, MolPort-005-932-352, EPA Pesticide Chemical Code 109302, CID50516

Molecular Formula:	C₂₆H₂₂ClF₃N₂O₃	Molecular Weight:	502.912690 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: INISTDXBRIBGOC-UHFFFAOYSA-N

• Dodecyl Isocyanate

IUPAC Name: 1-isocyanatododecane | CAS Registry Number: 4202-38-4
Synonyms: Dodecyl isocyanate, Dodecane, 1-isocyanato-, 389064_ALDRICH, CID77873, EINECS 224-111-0

Molecular Formula:	C₁₃H₂₅NO	Molecular Weight:	211.343700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: YIDSTEJLDQMWBR-UHFFFAOYSA-N

• Dofetilide

IUPAC Name: N-[4-[2-[2-[4-(methanesulfonamido)phenyl]ethyl-methylamino]ethoxy]phenyl]methanesulfonamide | CAS Registry Number: 115256-11-6
Synonyms: Tikosyn, Dofetilida, Dofetilidum, Xelide, Tikosyn (TN), Dofetilidum [INN-Latin], Dofetilida [INN-Spanish], 1-MSPMPE, Dofetilide [USAN:BAN:INN], MLS000759442, MLS001424185, Dofetilide (JAN/USAN/INN), CHEBI:4681, STOCK6S-54336, C19H27N3O5S2, CID71329, DB00204, UK 68,798, NCGC00164549-01, CPD000466333

Molecular Formula:	C₁₉H₂₇N₃O₅S₂	Molecular Weight:	441.564780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	8

InChIKey: IXTMWRCNAAVVAI-UHFFFAOYSA-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

• Dolasetron Mesylate

Synonyms: Anzemet, Anzemet (TN), DOLASETRON MESYLATE, Dolasetron mesylate (USP), CID441346, D00725

Molecular Formula:	C₂₀H₂₄N₂O₆S	Molecular Weight:	420.479360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	8

InChIKey: PSGRLCOSIXJUAL-UHFFFAOYSA-N

• Domiphen Bromide

IUPAC Name: dodecyl-dimethyl-(2-phenoxyethyl)azanium bromide | CAS Registry Number: 538-71-6
Synonyms: domiphen bromide, Oradol, Bradasol, Bradonit, Bradoral, Fungitex, Bradosol bromide, Fungitex R, Phenododecinium bromide, Oradol (TN), Domipheni bromidum [INN-Latin], HSDB 7236, 247480_ALDRICH, Bromure de domiphene [INN-French], Bromuro de domifeno [INN-Spanish], Domiphen bromide [USAN:BAN:JAN], EINECS 208-702-0, NSC-39415, Domiphen bromide (JAN/USAN/INN), CID10866

Molecular Formula:	C₂₂H₄₀BrNO	Molecular Weight:	414.463100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: OJIYIVCMRYCWSE-UHFFFAOYSA-M

• Domperidone Maleate

IUPAC Name: (E)-but-2-enedioic acid; 6-chloro-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-2-one | CAS Registry Number: 99497-03-7
Synonyms: 57808-66-9

Molecular Formula:	C₂₆H₂₈ClN₅O₆	Molecular Weight:	541.983420 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: OAUUYDZHCOULIO-WLHGVMLRSA-N

• Doramectin

Synonyms: Doramectin (JAN/USAN/INN), CID11954226, D01129

Molecular Formula:	C₅₀H₇₄O₁₄	Molecular Weight:	899.114160 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	14

InChIKey: QLFZZSKTJWDQOS-DLZZRMBFSA-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

• Doxepin Hydrochloride

IUPAC Name: (3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine hydrochloride | CAS Registry Number: 1229-29-4
Synonyms: Sinequan, Curatin, Adapin, Novoxapin, Aponal, Toruan, Doxepin HCl, Silenor, Zonalon, Doxepine hydrochloride, Novoxapin hydrochloride, Prestwick_187, Cidoxepin hydrochloride, MF 10 HCl, Doxepin Hydrochloride [USAN], C19H21NO.HCl, MLS000069794, MLS001148235, D4526_SIGMA, EINECS 214-966-8

Molecular Formula:	C₁₉H₂₂ClNO	Molecular Weight:	315.837080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: MHNSPTUQQIYJOT-SJDTYFKWSA-N

• Doxycycline

IUPAC Name: (2Z,4S,4aR,5S,5aR,6R,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methyl-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione | CAS Registry Number: 564-25-0
Synonyms: doxycycline, Doxytetracycline, Deoxymykoin, Vibramycin, Vibramycine, Vibravenos, Azudoxat, Doxitard, Doxivetin, Investin, Liviatin, Doxycen, Monodox, Ronaxan, Nordox, Spanor, Vibra-tabs, Doxy-Puren, Doxycyclin, Hydramycin

Molecular Formula:	C₂₂H₂₄N₂O₈	Molecular Weight:	444.434560 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	10

InChIKey: UEVKMCOZLJYVNG-NMMSOKQRSA-N

• Doxycycline HCl

IUPAC Name: (2Z,4S,4aR,5S,5aR,6R)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methyl-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione hydrochloride | CAS Registry Number: 10592-13-9
Synonyms: Doxycycline hyclate, Prestwick_1072, Doxycycline hydrochloride, MLS002154032, CID6420082, SMR001233359

Molecular Formula:	C₂₂H₂₅ClN₂O₈	Molecular Weight:	480.895500 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	10

InChIKey: VLUQVUWDECWBTL-WGDOXZFCSA-N

• Doxycycline Hyclate

IUPAC Name: (2Z,4S,4aR,5S,5aR,6R,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methyl-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione; ethanol; hydrate; dihydrochloride | CAS Registry Number: 24390-14-5
Synonyms: Periostat, Doryx, Vibra-tabs, Doxycycline hyclate, Periostat (TN), Vibra-tabs (TN), DOXY, Doryx (TN), Doxycycline hyclate (USP), Doxycycline hydrochloride hydrate, Doxycycline hydrochloride hydrate (JP15), D02129, (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide - ethanol (2:1) dihydrochloride hydrate

Molecular Formula:	C₄₆H₅₈Cl₂N₄O₁₈	Molecular Weight:	1025.874720 [g/mol]
H-Bond Donor:	16	H-Bond Acceptor:	22

InChIKey: QDDHZFKCHWYXJF-QJYIYOKRSA-N

• Doxycycline Sulfo-salicylate

IUPAC Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methyl-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione; 2-hydroxy-5-sulfobenzoic acid | CAS Registry Number: 60683-15-0
Synonyms: EINECS 262-378-5, CID6454018, 5-Sulphosalicylic acid, compound with 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxonaphthacene-2-carboxamide (1:1)

Molecular Formula:	C₂₉H₃₀N₂O₁₄S	Molecular Weight:	662.618500 [g/mol]
H-Bond Donor:	9	H-Bond Acceptor:	16

InChIKey: RGOQBQFOCKQRFS-GNWMQEPYSA-N

• Dropropizine

IUPAC Name: 3-(4-phenylpiperazin-1-yl)propane-1,2-diol | CAS Registry Number: 17692-31-8
Synonyms: dropropizine, Dipropizine, Catabex, Ditustat, Tussilex, Larylin, Katril, Ribex, Dopropizin, Levodropropizine, ()-Dropropizine, (+-)-Dropropizine, Prestwick_670, Catabex (TN), Dropropizine (R,S), Spectrum_000327, Dropropizinum [INN-Latin], Dropropizina [INN-Spanish], Prestwick0_000245, Prestwick1_000245

Molecular Formula:	C₁₃H₂₀N₂O₂	Molecular Weight:	236.310100 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: PTVWPYVOOKLBCG-UHFFFAOYSA-N

• Drospirenone

Synonyms: Dehydrospirorenone, Dihydrospirorenone, Yasmin, 1,2-Dihydrospirorenone, Drospirenone [INN], DRSP, 1,2-dihydro-spirorenone, Drospirenonum [INN-Latin], Drospirenona [INN-Spanish], 1, 2-Dihydrospirorenone, Drospirenone (USAN/INN), CCRIS 6523, CHEBI:50838, EINECS 266-679-2, ZK 30595, C24H30O3, ZK30595, BRN 4765500, SH-470, DB01395

Molecular Formula:	C₂₄H₃₀O₃	Molecular Weight:	366.493200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: METQSPRSQINEEU-HXCATZOESA-N

• Drostanolone Propionate

IUPAC Name: [(2R,5S,8R,9S,10S,13S,14S,17S)-2,10,13-trimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] propanoate | CAS Registry Number: 521-12-0
Synonyms: Drolban, Blackburn Compound, dromostanolone, Drostanolone, Emdisterone, Permastril, Masterid, Masteril, Masteron, Masterone, drostanolone propionate, MDHT, 2MDTP, Masteron (TN), Medrotestron propionate, Drolban (TN), 2M-DHTP, Dromostanolone proprionate, Medrotestrone propanoate, Medrotestrone propionate

Molecular Formula:	C₂₃H₃₆O₃	Molecular Weight:	360.530140 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: NOTIQUSPUUHHEH-UXOVVSIBSA-N

• Droxidopa

IUPAC Name: (2R,3S)-2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid | CAS Registry Number: 23651-95-8
Synonyms: droxidopa, DOPS, Dops (TN), Droxidopa (JAN/INN), CID443940, threo-3,4-DIHYDROXY PHENYL SERINE, D01277

Molecular Formula:	C₉H₁₁NO₅	Molecular Weight:	213.187340 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	6

InChIKey: QXWYKJLNLSIPIN-SFYZADRCSA-N

• Ebastine

IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[di(phenyl)methoxy]piperidin-1-yl]butan-1-one | CAS Registry Number: 90729-43-4
Synonyms: ebastine, Kestine, Ebastel, Estivan, Evastel, Bactil, Bastel, Kestin, Ebastinum [Latin], No-Sedat, Ebastina [Spanish], Kestine (TN), Ebastine [USAN:INN], Ebastine (JAN/USAN/INN), LAS W-090, STOCK6S-48249, C32H39NO2, LAS-W-090, RP 64305, NCGC00164603-01

Molecular Formula:	C₃₂H₃₉NO₂	Molecular Weight:	469.657560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: MJJALKDDGIKVBE-UHFFFAOYSA-N

• Ecdysterone

IUPAC Name: (2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one | CAS Registry Number: 5289-74-7
Synonyms: beta-Ecdysone, Polypodine A, Crustecdysone, Isoinokosterone, Viticosterone, Commisterone, Crustecdyson, Ecdysteron, 20-HYDROXYECDYSONE, 20-OH ecdysone, ECDYSONE, Insect moulting hormone, THE-7, MLS001164644, H5142_SIGMA, CHEBI:16587, AIDS013374, AIDS-013374, NSC629484, ZINC04165898

Molecular Formula:	C₂₇H₄₄O₇	Molecular Weight:	480.634060 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	7

InChIKey: NKDFYOWSKOHCCO-YPVLXUMRSA-N

• Econazole

IUPAC Name: 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole | CAS Registry Number: 27220-47-9
Synonyms: econazole, Ecostatin, Palavale, Pevaryl, Ifenec, Gyno-pevaryl, (+-)-Econazole, Gyno-Pevaryl 150, Spectrum_001223, Econazole (USAN/INN), Prestwick0_000304, Prestwick1_000304, Prestwick2_000304, Prestwick3_000304, Spectrum2_001439, Spectrum3_001467, Spectrum4_000446, Spectrum5_001033, BSPBio_000268, BSPBio_002993

Molecular Formula:	C₁₈H₁₅Cl₃N₂O	Molecular Weight:	381.683500 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: LEZWWPYKPKIXLL-UHFFFAOYSA-N

• Econazole Nitrate Salt

IUPAC Name: 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole; nitric acid | CAS Registry Number: 24169-02-6
Synonyms: Econazole nitrate, Spectazole, Pevaryl, Ifenec, Gyno-pevaryl, Epi-pevaryl, Palavale, Gyno-Pevaryl 150, Spectazole (TN), Prestwick_191, Econazole nitrate salt, (+-)-Econazole nitrate, Ambap2106, CCRIS 6031, MLS000028626, MLS001076561, E4632_SIGMA, Econazole nitrate (JAN/USP), SPECTRUM1501185, C18H15Cl3N2O.HNO3

Molecular Formula:	C₁₈H₁₆Cl₃N₃O₄	Molecular Weight:	444.696340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: DDXORDQKGIZAME-UHFFFAOYSA-N

• EDTA Ferric Ammonium

IUPAC Name: azanium; 2-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl-(2-oxido-2-oxoethyl)amino]acetate; iron(3+) | CAS Registry Number: 21265-50-9
Synonyms: EINECS 244-302-2, CID88842, Ethylenediaminetetracetic acid, ferric ammonium salt, LS-195449, Ferrate(1-), ((ethylenedinitrilo)tetraacetato)-, ammonium, Ammonium ((N,N'-ethylenebis(N-(carboxymethyl)glycinato))(4-)-N,N',O,O',ON,ON')ferrate(1-), ammonium iron(3+) 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate, Ferrate(-1), ((N,N'-1,2-ethanediylbis(N-(carboxymethyl)glycinato))(4-)-N,N',O,O',ON,ON')-, ammonium, Ferrate(1-), ((N,N'-1,2-ethanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO))(4-))-, ammonium, (OC-6-21)-, 11087-25-5, 142340-43-0, 15275-07-7, 192319-44-1, Ferrate(1-), [[N,N'-1,2-ethanediylbis[N-[(carboxy-.kappa.O)methyl]glycinato-.kappa.N,.kappa.O]](4-)]-, ammonium, (OC-6-21)-

Molecular Formula:	C₁₀H₁₆FeN₃O₈	Molecular Weight:	362.094340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	10

InChIKey: XNSQZBOCSSMHSZ-UHFFFAOYSA-K

• 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

• Effusanin A

Synonyms: EFFUSANINA, Ambap30220-43-0, CHEMBL2407387, ZINC26893082

Molecular Formula:	C₂₀H₂₈O₅	Molecular Weight:	348.433320 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: PXLVZESUZUOWAJ-SLMDOUBJSA-N

• Elcatonin

Synonyms: Carbocalcitonin, Adevirock, Adevirock (TN), Elcatonin [INN:JAN], Elcatonine [INN-French], Elcatoninum [INN-Latin], Elcatonina [INN-Spanish], Elcatonin (JP15/INN), HC-58, EINECS 262-393-7, (Aminosuberic acid 1,7)-eel calcitonin, LS-61711, D03287, C14H25N5O2.C8H16O.C2H6.2CH5N.CH2O, 1,7-Dicarbacalcitonin, 1-butanoic acid-26-L-aspartic acid-27-L-valine-29-L-alanine-, 1,7-Dicarbacalcitonin (salmon), 1-butanoic acid-26-L-aspartic acid-27-L-valine-29-L-alanine-, 1-Butyric acid-7-(L-2-aminobutyric acid)-26-L-aspartic acid-27-L-valine-29-L-alaninecalcitonin (salmon)

Molecular Formula:	C₁₄₈H₂₄₄N₄₂O₄₇	Molecular Weight:	3363.774160 [g/mol]
H-Bond Donor:	48	H-Bond Acceptor:	55

InChIKey: JYSJVJJVLNYRKL-QPHHPWFVSA-N

• Eleutheroside E1

IUPAC Name: (2S,3R,4S,5S,6R)-3-[(3aR,6aR)-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-1-yl]-2-[hydroxy(methoxy)methyl]-5-methoxy-6-phenoxyoxane-3,4,5-triol | CAS Registry Number: 7374-79-0
Synonyms: Acanthoside B, beta-D-Glucopyranoside, 2,6-dimethoxy-4-(tetrahydro-4-(4-hydroxy-3,5-dimethoxyphenyl)-1H,3H-furo(3,4-c)furan-1-yl)phenyl, (1S-(1alpha,3aalpha,4a,6aalpha))-

Molecular Formula:	C₂₈H₃₆O₁₃	Molecular Weight:	580.577640 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	13

InChIKey: JOKFTZNLURGDGR-HKAPORTGSA-N

• Emamectin

Synonyms: MK 243, MK-243, 4''-epi-Methylamino-4''-deoxyavermectin B1, Avermectin B1, 4''-deoxy-4''-(methylamino)-, (4''R)-

Molecular Formula:	C₉₇H₁₄₆O₂₆	Molecular Weight:	1728.181540 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	26

InChIKey: WQYWHGOKYSMVFW-ZOKDRQBOSA-N

• Emtricitabine

IUPAC Name: 4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one | CAS Registry Number: 143491-57-0
Synonyms: Emtriva, Coviracil, Racivir, Truvada, Mixture Name, dOTFC, Emtriva (TN), (-)-FTC, 2-FTC, (-)-.beta.-L-FTC, BW524W91, C8H10FN3O3S, DRG-0208, Emtricitabine (JAN/USAN/INN), HSDB 7337, 2'-Deoxy-5-fluoro-3'-thiacytidine, BW 524W91, BW-524W91, FTC, (-)-, AIDS004782

Molecular Formula:	C₈H₁₀FN₃O₃S	Molecular Weight:	247.246703 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: XQSPYNMVSIKCOC-NTSWFWBYSA-N

• Enalapril

IUPAC Name: (2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 75847-73-3
Synonyms: enalapril, Spectrum_001307, Prestwick3_000314, Spectrum2_001455, Spectrum3_001478, Spectrum4_000008, Spectrum5_001107, BSPBio_000308, BSPBio_003035, KBioGR_000355, KBioSS_001787, DivK1c_000408, SPBio_001349, BPBio1_000340, KBio1_000408, KBio2_001787, KBio2_004355, KBio2_006923, KBio3_002535, NINDS_000408

Molecular Formula:	C₂₀H₂₈N₂O₅	Molecular Weight:	376.446720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: GBXSMTUPTTWBMN-XIRDDKMYSA-N

• Enalapril Maleate

IUPAC Name: (Z)-but-2-enedioic acid; (2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 76095-16-4
Synonyms: Enalapril maleate, Renivace, Vasotec, Benalapril, Baripril, Crinoren, Innovace, Naprilene, Dabonal, Enapren, Renitec, Xanef, enalapril, Benalipril, Controlvas, Acetensil, Biocronil, Converten, Convertin, Coprilor

Molecular Formula:	C₂₄H₃₂N₂O₉	Molecular Weight:	492.518880 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	10

InChIKey: OYFJQPXVCSSHAI-QFPUQLAESA-N

• Enalaprilate

IUPAC Name: (2R)-1-[(2S)-2-[[(2R)-1-hydroxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 84680-54-6
Synonyms: Enalapril acid, Enalaprilat, Enalapril diacid, Enalaprilic acid, Enalaprilat anhydrous, enalaprilat [Spanish], MK 421 diacid, Enalaprilate [French], Enalaprilatum [Latin], EINECS 278-459-3, MK 422, CID5362033, N-(1(S)-Carboxy-3-phenylpropyl)-L-alanyl-L-proline, L-Proline, N-((1S)-1-carboxy-3-phenylpropyl)-L-alanyl-, L-Proline, 1-(N-(1-carboxt-3-phenylpropyl)-L-alanyl)-, (S)-, 76420-72-9

Molecular Formula:	C₁₈H₂₄N₂O₅	Molecular Weight:	348.393560 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: LZFZMUMEGBBDTC-NWANDNLSSA-N

• Enfuvirtide(T-20)

IUPAC Name: 5-cyclohexyl-5-(thiolan-3-yl)imidazolidine-2,4-dione | CAS Registry Number: 74038-65-6
Synonyms: 5-cyclohexyl-5-(thiolan-3-yl)imidazolidine-2,4-dione, AC1L1DSF, CTK2H9215

Molecular Formula:	C₁₃H₂₀N₂O₂S	Molecular Weight:	268.375100 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: GOJUOPOQMGDIHD-UHFFFAOYSA-N

• ENILCONAZOLE

IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole | CAS Registry Number: 73790-28-0
Synonyms: Enilconazole, IMAZALIL, Chloramizol, Deccozil, Fungaflor, Imaverol, 35554-44-0, Eniloconazol (SP), Deccozil S 75, Enilconazole (BPC), Caswell No. 497AB, R 23979, Imazalil [ANSI:BSI:ISO], 1-(2-(Allyloxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole, HSDB 6672, EINECS 252-615-0, CGA 41333, EPA Pesticide Chemical Code 111901, BRN 0545683, 1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole

Molecular Formula:	C₁₄H₁₄Cl₂N₂O	Molecular Weight:	297.179760 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: PZBPKYOVPCNPJY-UHFFFAOYSA-N

• Enocitabine

IUPAC Name: N-[1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]docosanamide | CAS Registry Number: 55726-47-1
Synonyms: enocitabine, Sunrabin, sunrabim, behenoyl ara-C, Sunrabin (TN), BHAC, Enocitabine [INN:JAN], Enocitabinum [INN-Latin], N(4)-behenoyl ara-C, Behenoylcytosine arabinoside, BH-AC, Enocitabina [INN-Spanish], Enocitabine (JAN/INN), C31H55N3O6, N(sup 4)-Behenoylcytosine arabinoside, NSC-239336, BRN 0772101, NSC 239336, NCGC00167515-01, LS-63369

Molecular Formula:	C₃₁H₅₅N₃O₆	Molecular Weight:	565.784900 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: SAMRUMKYXPVKPA-VFKOLLTISA-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

• Enrofloxacin Hydrochloride

IUPAC Name: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid;hydrochloride | CAS Registry Number: 112732-17-9
Synonyms: Enrofloxacin hydrochloride, Enrofloxacin HCl, MolPort-005-934-025, AKOS015896571, O718, FT-0687706, I06-2346

Molecular Formula:	C₁₉H₂₃ClFN₃O₃	Molecular Weight:	395.855623 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: PZJWYUDBXNNVLZ-UHFFFAOYSA-N

• Eperisone hydrochloride

IUPAC Name: 1-(4-ethylphenyl)-2-methyl-3-piperidin-1-ylpropan-1-one hydrochloride | CAS Registry Number: 56839-43-1
Synonyms: Myonal, Mional, eperisone, Epenard, EMPP, Epenard (TN), Ambap6378, 4-EMPP, C17H25NO.HCl, Eperisone hydrochloride (JP15), E-646, (4'-ethyl-2-methyl-3-piperidino)propiophenone, E 0646, LS-125265, D01671, E-0646, E-2000, 4'-Ethyl-2-methyl-3-piperidinopropiophenone hydrochloride, Propiophenone, 4'-ethyl-2-methyl-3-piperidino-, hydrochloride, 1-Propanone, 1-(4-ethylphenyl)-2-methyl-3-(1-piperidinyl)-, hydrochloride

Molecular Formula:	C₁₇H₂₆ClNO	Molecular Weight:	295.847440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: GTAXGNCCEYZRII-UHFFFAOYSA-N

• Ephedrine Hydrochloride

IUPAC Name: (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochloride | CAS Registry Number: 50-98-6
Synonyms: Ephedronguent, Bronkotabs, Quadrinal, Altusin, Tedral, Bena-fedrin, Primatene Tablets, Ephedrine hydrochloride, Mixture Name, Mudrane GG Elixir, Ephedrinium chloride, L-Ephedrine hydrochloride, 1-Ephedrine hydrochloride, l-Ephedrine, hydrochloride, (-)-Ephedrin hydrochloride, (-)-Ephedrine hydrochloride, Ephedrine L- hydrochloride, C10H15NO.HCl, Ephedrine hydrochloride (TN), 285749_ALDRICH

Molecular Formula:	C₁₀H₁₆ClNO	Molecular Weight:	201.693140 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	2

InChIKey: BALXUFOVQVENIU-GNAZCLTHSA-N

• EPIANDROSTERONE ACETATE

IUPAC Name: [(5R,10R,13R,17R)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] acetate | CAS Registry Number: 1289-31-2

Molecular Formula:	C₂₁H₃₂O₃	Molecular Weight:	332.484 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: ILCTUFVQFCIIDS-OWMJMTPHSA-N

• Epiestradiol

IUPAC Name: (8R,9S,13S,14S,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol | CAS Registry Number: 57-91-0
Synonyms: Alfatradiol, alpha-Estradiol, estradiol, 17alpha-Estradiol, Estradiol-17alpha, 17-alpha-Estradiol, 17alpha estradiol, .alpha.-Estradiol, Alfatradiol (INN), nchembio775-comp6, 17.alpha.-Estradiol, nchembio.106-comp4, 17.alpha.-Oestradiol, Oestradiol-17.alpha., Estradiol, 17.alpha.-, 3,17-Dihydroxyestratriene, UPCMLD-DP131, KBioGR_002281, KBioSS_002282, E8750_SIGMA

Molecular Formula:	C₁₈H₂₄O₂	Molecular Weight:	272.381960 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: VOXZDWNPVJITMN-SFFUCWETSA-N

• Epimedium Extract

IUPAC Name: 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one | CAS Registry Number: 489-32-7
Synonyms: Icariin, Spectrum2_001695, Spectrum3_001130, Spectrum4_001975, Spectrum5_000933, BSPBio_002599, KBioGR_002475, MLS000759413, MLS001424083, SPECTRUM1505257, SPBio_001650, KBio3_002099, BB_NC-0999, Anhydroicaritin-3-O-alpha-rhamnoside, ZINC03960893, CID5318997, SDCCGMLS-0066754.P001, NCGC00178583-01, CPD000466309, SAM001246560

Molecular Formula:	C₃₃H₄₀O₁₅	Molecular Weight:	676.661700 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	15

InChIKey: TZJALUIVHRYQQB-XLRXWWTNSA-N

• Epinastine

Synonyms: Alesion, Elestat, Flurinol, Relestat, Epinastine hydrochloride, Alesion (TN), Elestat (TN), Epinastine monohydrochloride, WAL-801CL, WAL 801 CL, C16H15N3.HCl, E5156_SIGMA, Epinastine hydrochloride (JAN), CID157313, LS-60567, D01713, 3-Amino-9,13b-dihydro-1H-dibenz(c,f)imidazo(1,5-a)azepine monohydrochloride, 9,13b-Dihydro-1H-dibenz[cf]imidazo[1,5-a]azepine hydrochloride, IH-Dibenz(c,f)imidazo(1,5-a)azepin-3-amine, 9,13b-dihydro-, monohydrochloride, 108929-04-0

Molecular Formula:	C₁₆H₁₆ClN₃	Molecular Weight:	285.771340 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: VKXSGUIOOQPGAF-UHFFFAOYSA-N

• Epinephrine

IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol | CAS Registry Number: 329-65-7
Synonyms: Racepinephrine, epinephrine, DL-Adrenaline, Racepinefrine, Epirenamine, Vaponefrin, Eppy, d-Adrenaline, D-Epinephrine, adrenaline, Epinephrine dl-, Epinephrine racemic, (+-)-Adrenaline, (+-)-Epinephrine, Adrenaline I, ()-Epinephrine, ()-Adrenalin, L-(+)-Adrenaline, ( )-Epinephrine, nchembio801-comp3

Molecular Formula:	C₉H₁₃NO₃	Molecular Weight:	183.204420 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	4

InChIKey: UCTWMZQNUQWSLP-UHFFFAOYSA-N

• Epirubicin

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 | CAS Registry Number: 56420-45-2
Synonyms: Epiadriamycin, 4'-Epiadriamycin, Epidoxorubicin, Ridorubicin, Ellence, 4'-epidoxorubicin, Farmorubicin, Pidorubicin, 4-Epidoxorubicin, Epi-DX, Epirubicine [French], Epirubicinum [Latin], Epirubicina [Spanish], 4'-epi-Doxorubicin, Epirubicine [INN-French], Epirubicinum [INN-Latin], Epirubicin [INN:BAN], Epirubicina [INN-Spanish], Pidorubicine [INN-French], Pidorubicinum [INN-Latin]

Molecular Formula:	C₂₇H₂₉NO₁₁	Molecular Weight:	543.519260 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	12

InChIKey: AOJJSUZBOXZQNB-VTZDEGQISA-N

• Epoxiconazol

IUPAC Name: 1-[[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl]-1,2,4-triazole | CAS Registry Number: 106325-08-0
Synonyms: Epoxiconazole, Epoxiconazole [ISO], CID3317081

Molecular Formula:	C₁₇H₁₃ClFN₃O	Molecular Weight:	329.756023 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: ZMYFCFLJBGAQRS-UHFFFAOYSA-N