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Profile: Shanghai Longschem Co., Ltd. is specialized in development, manufacture and sales of APIs, pharmaceutical intermediates, intermediates for pesticides & dyes, electronic chemicals and fine chemicals.

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• Adenine

IUPAC Name: 7H-purin-6-amine | CAS Registry Number: 73-24-5
Synonyms: adenine, 6-Aminopurine, Adenin, Adeninimine, 1H-Purin-6-amine, Vitamin B4, Leuco-4, 2-aminopurine, Purine, 6-amino-, 9H-Purin-6-amine, Leucon, 6-Amino-1H-purine, 6-Amino-3H-purine, 6-Amino-7H-purine, 6-Amino-9H-purine, adenine-ring, Pedatisectine B, Adenine [JAN], 1jys, 1nli

Molecular Formula:	C₅H₅N₅	Molecular Weight:	135.126700 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: GFFGJBXGBJISGV-UHFFFAOYSA-N

• Adenine Phosphate

IUPAC Name: phosphoric acid;7H-purin-6-amine | CAS Registry Number: 70700-30-0
Synonyms: Adenine phosphate, 52175-10-7, 6-Aminopurine phosphate, 7H-Purin-6-amine phosphate, 1H-Purin-6-amine, phosphate, EINECS 257-702-7, PubChem9684, SureCN283728, SureCN283729, AC1L550T, MolPort-003-984-187, MolPort-006-108-180, phosphoric acid; 7H-purin-6-amine, 6-amino-1H-purine; phosphoric acid, AKOS015895413, AKOS015961504, AKOS016008799, AC-5490, AM83910, RP17554

Molecular Formula:	C₅H₈N₅O₄P	Molecular Weight:	233.121882 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	8

InChIKey: CCHNOBQMQBSRHQ-UHFFFAOYSA-N

• Alpha Hydroxy Phenyl Acetic Acid

IUPAC Name: 2-hydroxy-2-phenylacetic acid | CAS Registry Number: 90-64-2
Synonyms: MANDELIC ACID, dl-Mandelic acid, Uromaline, Amygdalic acid, Almond acid, p-Mandelic acid, Phenylglycolic acid, Mandelsaeure, Paramandelic acid, Amygdalinic acid, L-mandelic acid, Racemic mandelic acid, Phenylhydroxyacetic acid, Glycolic acid, phenyl-, (RS)-Mandelic acid, Hydroxy(phenyl)acetic acid, 2-Phenylglycolic acid, (r)-mandelic acid, (+-)-Mandelic acid, (S)-Mandelic acid

Molecular Formula:	C₈H₈O₃	Molecular Weight:	152.147320 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IWYDHOAUDWTVEP-UHFFFAOYSA-N

• Aripiprazole

IUPAC Name: 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one | CAS Registry Number: 129722-12-9
Synonyms: Abilify, Abilitat, Abilify Discmelt, Aripirazole, Discmelt, Aripiprazole [USAN], Abilify (TN), OPC 31, Opc 14597, OPC-14597, HSDB 7320, MLS000759517, MLS001165779, MLS001195621, MLS001424078, C23H27Cl2N3O2, Aripiprazole (JAN/USAN/INN), OPC-31, STOCK6S-52961, CHEBI:31236

Molecular Formula:	C₂₃H₂₇Cl₂N₃O₂	Molecular Weight:	448.385380 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: CEUORZQYGODEFX-UHFFFAOYSA-N

• Benzoxazolinone

IUPAC Name: 3H-1,3-benzoxazol-2-one | CAS Registry Number: 59-49-4
Synonyms: Benzoxazolone, 2-BENZOXAZOLINONE, 2-Benzoxazolol, 2(3H)-Benzoxazolone, benzoxazolone-2, 2-Hydroxybenzoxazole, benzoxazolin-2-one, Benzoxazole, 2-hydroxy-, benzoxazolone zinc salt, 3H-benzooxazol-2-one, 2(3H)-Benzoxazolinone, benzoxazolin-2(3H)-one, USAF EK-5429, BENZOXAZOLINE,2-ONE, WLN: T56 BMVOJ, 1,3-Benzoxazol-2(3H)-one, CCRIS 6794, C7H5NO2, MLS000515797, 157058_ALDRICH

Molecular Formula:	C₇H₅NO₂	Molecular Weight:	135.120100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ASSKVPFEZFQQNQ-UHFFFAOYSA-N

• Carbonyl Diimidazole

IUPAC Name: di(imidazol-1-yl)methanone | CAS Registry Number: 530-62-1
Synonyms: Carbonyldiimidazole, Carbonyl diimidazole, N,N'-Carbonyldiimidazole, N,N-Carbonyldiimidazole, Diimidazol-1-yl ketone, 1,1'-Carbonyldiimidazole, N,N?Carbonyldiimidazole, N,N'-Carbonylbis(imidazole), 1-Oxomethylenebis(N-imidazole), 1H-Imidazole, 1,1'-carbonylbis-, Imidazole, 1,1'-carbonyldi-, CCRIS 2606, NCIOpen2_000076, 1,1'-Carbonylbis-1H-imidazole, 1,1'-carbonylbis(1H-imidazole), 115533_ALDRICH, 09943_FLUKA, 21860_FLUKA, EINECS 208-488-9, NSC 67203

Molecular Formula:	C₇H₆N₄O	Molecular Weight:	162.148740 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: PFKFTWBEEFSNDU-UHFFFAOYSA-N

• Cefotiam

IUPAC Name: (6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-[[1-(2-dimethylaminoethyl)tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid dihydrochloride | CAS Registry Number: 66309-69-1
Synonyms: Pansporin, Halospor, Ceradon, Spizef, Pansporine, Pansporin Ampullen, Pansporin (TN), CEFOTIAM HYDROCHLORIDE, Ceradon (TN), Cefotiam dihydrochloride, Abbott 48999, Abbott-48999, SCE-963 dihydrochloride, Cefotiam hydrochloride [USAN:JAN], C18H23N9O4S3.2HCl, EINECS 266-312-6, SCE 963, SCE-963, CGP-14221/E, CID47896

Molecular Formula:	C₁₈H₂₅Cl₂N₉O₄S₃	Molecular Weight:	598.550000 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	11

InChIKey: BWRRTAXZCKVRON-DGPOFWGLSA-N

• Citalopram HBR

IUPAC Name: 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile;hydrobromide

Molecular Formula:	C₂₀H₂₂BrFN₂O	Molecular Weight:	405.303883 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: WIHMBLDNRMIGDW-UHFFFAOYSA-N

• Deticene

IUPAC Name: (5Z)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide | CAS Registry Number: 4342-03-4
Synonyms: dacarbazine, Biocarbazine, Decarbazine, DTIC-Dome, Biocarbazine R, Imidazole carboxamide, DTIC, ICDT, DTICDome, DTIE, ICDMT, DTIC Dome, Spectrum_000884, Prestwick0_000574, Prestwick1_000574, Prestwick2_000574, Prestwick3_000574, Spectrum2_001148, Spectrum3_000366, Spectrum4_000308

Molecular Formula:	C₆H₁₀N₆O	Molecular Weight:	182.183200 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: OMJKFYKNWZZKTK-POHAHGRESA-N

• Diethyl Pyrocarbonate

IUPAC Name: ethyl 2-ethylperoxy-2-oxoacetate | CAS Registry Number: 1609-47-8
Synonyms: Baycovin, Piref, Diethyl dicarbonate, Diethyl oxydiformate, diethyl pyrocarbonate, Ethyl pyrocarbonate, DEPC, Diethylpyrocarbonate, Dicarbonate, Diethyl, Ethoxyformic anhydride, Oxydiformate, Diethyl, Diethyl pyrocarbonic acid, Pyrocarbonate, Diethyl, Anhydride, Ethoxyformic, Ethoxyformic acid anhydride, Diethylpyrokarbonat [Czech], Dicarbonic acid, diethyl ester, Pyrocarbonic acid diethyl ester, Dicarbonic acid diethyl ester, Oxydiformic acid diethyl ester

Molecular Formula:	C₆H₁₀O₅	Molecular Weight:	162.140600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: MUHLODGHNSIQPP-UHFFFAOYSA-N

• Dl Mandelic Acid

IUPAC Name: 2-hydroxy-2-phenylacetic acid | CAS Registry Number: 611-72-3
Synonyms: MANDELIC ACID, dl-Mandelic acid, Uromaline, Amygdalic acid, Almond acid, p-Mandelic acid, Phenylglycolic acid, Mandelsaeure, Paramandelic acid, Amygdalinic acid, L-mandelic acid, Racemic mandelic acid, Phenylhydroxyacetic acid, Glycolic acid, phenyl-, (RS)-Mandelic acid, Hydroxy(phenyl)acetic acid, 2-Phenylglycolic acid, (r)-mandelic acid, (+-)-Mandelic acid, (S)-Mandelic acid

Molecular Formula:	C₈H₈O₃	Molecular Weight:	152.147320 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IWYDHOAUDWTVEP-UHFFFAOYSA-N

• Famotidine

IUPAC Name: 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoylpropanimidamide | CAS Registry Number: 76824-35-6
Synonyms: famotidine, Gastridin, Pepcidine, Quamatel, Famodil, Pepdine, Gaster, Pepdul, Apogastine, Gastrodomina, Gastrosidin, Supertidine, Antodine, Bestidine, Blocacid, Confobos, Digervin, Dispromil, Dispronil, Fagastine

Molecular Formula:	C₈H₁₅N₇O₂S₃	Molecular Weight:	337.445400 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	9

InChIKey: XUFQPHANEAPEMJ-UHFFFAOYSA-N

• Fexofenadine HCL

IUPAC Name: 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid hydrochloride | CAS Registry Number: 153439-40-8
Synonyms: Allegra, Telfast, fexofenadine, Altiva, Allegra Flash, Allegra (TN), ALLEGRA-D, FEXOFENADINE HYDROCHLORIDE, Fexofenidine hydrochloride, MDL 16455 hydrochloride, C32H39NO4.HCl, MLS001306422, MLS001332493, MLS001332494, F9427_SIGMA, SPECTRUM1504179, Carboxyterfenadine hydrochloride, MDL 16,455A, Terfenadine carboxylate hydrochloride, Fexofenadine hydrochloride [USAN]

Molecular Formula:	C₃₂H₄₀ClNO₄	Molecular Weight:	538.117300 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: RRJFVPUCXDGFJB-UHFFFAOYSA-N

• Fexofenadine hydrochloride

IUPAC Name: 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid hydrochloride | CAS Registry Number: 138452-21-8
Synonyms: Allegra, Telfast, fexofenadine, Altiva, Allegra Flash, Allegra (TN), ALLEGRA-D, FEXOFENADINE HYDROCHLORIDE, Fexofenidine hydrochloride, MDL 16455 hydrochloride, C32H39NO4.HCl, MLS001306422, MLS001332493, MLS001332494, F9427_SIGMA, SPECTRUM1504179, Carboxyterfenadine hydrochloride, MDL 16,455A, Terfenadine carboxylate hydrochloride, Fexofenadine hydrochloride [USAN]

Molecular Formula:	C₃₂H₄₀ClNO₄	Molecular Weight:	538.117300 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: RRJFVPUCXDGFJB-UHFFFAOYSA-N

• Fluoxetine

IUPAC Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine | CAS Registry Number: 54910-89-3
Synonyms: fluoxetine, Pulvules, Portal, Eufor, Prozac, Animex-On, Floxetine, Fluoxetin, Deprex, Fluval, Fluoxetine Hcl, Fluoxetina [Spanish], Fluoxetine (TN), fluoxetine (Prozac), Fluoxetinum [INN-Latin], Fluoxetina [INN-Spanish], (+/-)-Fluoxetine, Spectrum_001679, SpecPlus_000723, Fluoxetine (USAN/INN)

Molecular Formula:	C₁₇H₁₈F₃NO	Molecular Weight:	309.326130 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: RTHCYVBBDHJXIQ-UHFFFAOYSA-N

• Guanine

IUPAC Name: 2-amino-3,7-dihydropurin-6-one | CAS Registry Number: 73-40-5
Synonyms: guanine, Mearlmaid, Pathocidin, Guanin, Pearl essence, Guanine enol, Stella Polaris, Naturon, Dew Pearl, 2-Amino-6-hydroxypurine, cytosine, 2-Aminohypoxanthine, Natural white 1, Purine analog, 2-Amino-6-purinol, CI Natural white 1, Mearlmaid AA, Natural pearl essence, Hypoxanthine, 2-amino-, 6-Hydroxy-2-aminopurine

Molecular Formula:	C₅H₅N₅O	Molecular Weight:	151.126100 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: UYTPUPDQBNUYGX-UHFFFAOYSA-N

• Guanosine

IUPAC Name: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | CAS Registry Number: 118-00-3
Synonyms: guanosine, vernine, guanine riboside, Guanozin, Guanosin, nucleoside Q, Vernine (VAN), 1odj, 2fqx, Inosine, 2-amino-, Inosine, 2-amino, nchembio.136-comp1, USAF CB-11, 9-beta-D-Ribofuranosylguanine, Inosine, 2-amino- (VAN), beta-D-Ribofuranoside, guanine-9, Guanine, 9-beta-D-ribofuranosyl-, Ribofuranoside, guanine-9, beta-D-, nchembio.2007.33-comp42, SGCUT00093

Molecular Formula:	C₁₀H₁₃N₅O₅	Molecular Weight:	283.240720 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	9

InChIKey: NYHBQMYGNKIUIF-UUOKFMHZSA-N

• Hydroxylimine Hydrochloride

IUPAC Name: 1-[C-(2-chlorophenyl)-N-methylcarbonimidoyl]cyclopentan-1-ol;hydrochloride | CAS Registry Number: 90717-16-1
Synonyms: 1-[(2-CHLOROPHENYL)-N-(METHYLIMINO)METHYL]CYCLOPENTANOL HYDROCHLORIDE, 1-((2-Chlorophenyl)(methylimino)methyl)cyclopentanol hydrochloride, 1-[(2-Chlorophenyl)(methylimino)methyl]cyclopentanol Hydrochloride, AGN-PC-00KTPP, MolPort-020-002-347, AKOS015895593, AKOS016010418, AK116492, FT-0642180, ST51052908, A843617, 1-[(2-chlorophenyl)-methyliminomethyl]-1-cyclopentanol hydrochloride, 1-[C-(2-chlorophenyl)-N-methyl-carbonimidoyl]cyclopentan-1-ol hydrochloride, 2-Chlorophenyl-1-hydroxy-1-cyclopentyl N-Methyl Ketimine Hydrochloride, Cyclopentanol, 1-[(2-chlorophenyl)(methylimino)methyl]-, hydrochloride

Molecular Formula:	C₁₃H₁₇Cl₂NO	Molecular Weight:	274.186180 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: CKDXSVLVPYBGPG-UHFFFAOYSA-N

• Hypoxanthine

IUPAC Name: 3,7-dihydropurin-6-one | CAS Registry Number: 68-94-0
Synonyms: hypoxanthine, 6-Hydroxypurine, Sarcine, Sarkine, Sarkin, 6-Oxopurine, Hypoxanthine enol, 9H-Purin-6-ol, Purin-6-ol, Purine analog, Purin-6(1H)-one, Purine-6-ol, 6(1H)-Purinone, 3H-Purin-6-ol, Purin-6(3H)-one, 1vfn, 6-Hydroxy-1H-purine, 9H-Purin-6(1H)-one, Hypoxanthine (VAN), Hypoxanthine-8-14C

Molecular Formula:	C₅H₄N₄O	Molecular Weight:	136.111460 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: FDGQSTZJBFJUBT-UHFFFAOYSA-N

• Imidazole

IUPAC Name: 1H-imidazole | CAS Registry Number: 288-32-4
Synonyms: imidazole, Glyoxaline, 1H-Imidazole, Iminazole, Imidazol, Miazole, Glyoxalin, Imutex, 1,3-Diazole, Pyrro(b)monazole, Pyrro[b]monazole, Glioksal [Polish], Imidazole solution, Glyoxaline solution, Imidazole (8CI), 1,3-Diaza-2,4-cyclopentadiene, IMIDAZOLE-RING, Formamidine, N,N'-vinylene-, USAF EK-4733, 1H-Imidazole (9CI)

Molecular Formula:	C₃H₄N₂	Molecular Weight:	68.077260 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: RAXXELZNTBOGNW-UHFFFAOYSA-N

• Indole-2-Carboxylic Acid

IUPAC Name: 1H-indole-2-carboxylic acid | CAS Registry Number: 1477-50-5
Synonyms: 2-Carboxyindole, Indole-2-carboxylic acid, 2-Indolecarboxylic acid, 1H-Indole-2-carboxylic acid, Spectrum_001485, SpecPlus_000676, Spectrum2_000021, Spectrum3_000943, Spectrum4_001042, Spectrum5_001735, I5109_ALDRICH, Oprea1_557882, KBioGR_001304, KBioSS_001965, DivK1c_006772, SPECTRUM1502082, SPBio_000081, INDOLE-2-CARBOXLIC ACID, EINECS 216-030-4, KBio1_001716

Molecular Formula:	C₉H₇NO₂	Molecular Weight:	161.157380 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: HCUARRIEZVDMPT-UHFFFAOYSA-N

• Indole-3-Carbinol

IUPAC Name: 1H-indol-3-ylmethanol | CAS Registry Number: 700-06-1
Synonyms: Indole-3-carbinol, 3-Indolylcarbinol, 3-Hydroxymethylindole, Indinol, INDOLE-3-METHANOL, 3-Indolemethanol, I3C cpd, 1H-indol-3-ylmethanol, 1H-Indole-3-methanol, Spectrum2_001710, Spectrum3_001973, C9H9NO, CCRIS 3261, BSPBio_003573, MLS001333161, MLS001333162, I7256_SIGMA, SPECTRUM1505320, SPBio_001700, Prevention 4 (indole-3-carbinol)

Molecular Formula:	C₉H₉NO	Molecular Weight:	147.173860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: IVYPNXXAYMYVSP-UHFFFAOYSA-N

• Isoquinoline-1-Carboxylic Acid

IUPAC Name: isoquinoline-1-carboxylic acid | CAS Registry Number: 486-73-7
Synonyms: 1-Isoquinolinecarboxylic acid, Isoquinoline-1-carboxylic acid, 150134_ALDRICH, 58752_FLUKA, ALBB-005987, EINECS 207-639-6, NSC218351, AI3-61946, ST5308467

Molecular Formula:	C₁₀H₇NO₂	Molecular Weight:	173.168080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: XAAKCCMYRKZRAK-UHFFFAOYSA-N

• Levosulpiride

IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-methoxy-5-sulfamoylbenzamide | CAS Registry Number: 23672-07-3
Synonyms: Levopraid, Levogastrol, Levopraid (TN), (-)-Sulpiride, Levosulpiride (INN), Tocris-0895, (S)-(-)-sulpiride, Sulpiride [L-(-)], Biomol-NT_000030, Lopac0_001089, MLS000759490, MLS001424014, S7771_SIGMA, 34002_RIEDEL, BPBio1_001221, (S)-(−)-Sulpiride, PDSP1_000516, PDSP1_000620, PDSP1_001649, PDSP2_000514

Molecular Formula:	C₁₅H₂₃N₃O₄S	Molecular Weight:	341.425820 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: BGRJTUBHPOOWDU-NSHDSACASA-N

• Lomustine

IUPAC Name: 1-(2-chloroethyl)-3-cyclohexyl-1-nitrosourea | CAS Registry Number: 13010-47-4
Synonyms: lomustine, Belustine, Cecenu, CeeNU, CCNU, CINU, Lomustinum [INN-Latin], Lomustina [INN-Spanish], Lomustine medac Brand, Chloroethylcyclohexylnitrosourea, CeeNU (TN), Lomustine (USAN/INN), medac Brand of Lomustine, CCRIS 860, Lomustine [USAN:BAN:INN], ICIG 1109, NCIMech_000220, C9H16ClN3O2, NCI-C04740, NSC 79037

Molecular Formula:	C₉H₁₆ClN₃O₂	Molecular Weight:	233.695240 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: GQYIWUVLTXOXAJ-UHFFFAOYSA-N

• N-(4-Aminobenzoyl)-L-Glutaminic Acid

IUPAC Name: 2-[(4-aminobenzoyl)amino]pentanedioic acid | CAS Registry Number: 4271-30-1
Synonyms: p-Aminobenzoylglutamic acid, 4-Aminobenzoylglutamic acid, p-Aminobenzoyl-L-glutamic acid, NCIOpen2_003503, N-(p-Aminobenzoyl)glutamic acid, L-N-(p-Aminobenzoyl)glutamic acid, N-(4-Aminobenzoyl)-L-glutamic acid, N-4-Aminobenzoyl-L-glutamic acid, NSC71042, EINECS 224-261-7, NSC 71042, NSC267432, L-Glutamic acid, N-(4-aminobenzoyl)-, N-(p-Aminobenzoyl)glutamic acid (VAN), Glutamic acid, N-(p-aminobenzoyl)-, L-, TL8003030, L-Glutamic acid, N-(4-aminobenzoyl)- (9CI), Glutamic acid, N-(p-aminobenzoyl)-, L- (8CI), 4230-33-5

Molecular Formula:	C₁₂H₁₄N₂O₅	Molecular Weight:	266.249960 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: GADGMZDHLQLZRI-UHFFFAOYSA-N

• N-{4-[4-(piperidinomethyl)pyridyl-2-Oxy]-Cis-2-Butene}phthalimide Maleate

IUPAC Name: but-2-enedioic acid;2-[4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]isoindole-1,3-dione | CAS Registry Number: 146447-26-9
Synonyms: (Z)-2-(4-((4-(Piperidin-1-ylmethyl)pyridin-2-yl)oxy)but-2-en-1-yl)isoindoline-1,3-dione maleate, CTK8B4372, N-{4-[4-(Piperidinomethyl)pyridyl-2-oxy]-cis-2-butene}phthalimide maleic acid, ACT06269, ANW-44861, A808508, (Z)-2-(4-(4-(piperidin-1-ylmethyl)pyridin-2-yloxy)but-2-enyl)isoindoline-1,3-dione maleate, but-2-enedioic acid; 2-[4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]but-2-enyl]isoindole-1,3-dione, but-2-enedioic acid; 2-[4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]isoindole-1,3-dione

Molecular Formula:	C₂₇H₂₉N₃O₇	Molecular Weight:	507.535060 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: CKMFWYSSYXTDBF-UHFFFAOYSA-N

• N-Methylimidazole

IUPAC Name: 1-methylimidazole | CAS Registry Number: 616-47-7
Synonyms: 1-methylimidazole, 1H-Imidazole, 1-methyl-, IMIDAZOLE, 1-METHYL-, 1-Methyl-1H-imidazole, Lopac-M-8878, 1-Methylimidazole solution, WLN: T5N CNJ A1, Lopac0_000831, M50834_ALDRICH, 336092_ALDRICH, 06849_FLUKA, 67560_FLUKA, EINECS 210-484-7, NSC 88064, NSC88064, SBB007574, NCGC00015702-01, NCGC00094162-01, NCGC00094162-02, Cap B (1-methylimidazole 16% in THF)

Molecular Formula:	C₄H₆N₂	Molecular Weight:	82.103840 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: MCTWTZJPVLRJOU-UHFFFAOYSA-N

• N-Sulphamyl-3-Chloropropionamidine Hydrochloride

IUPAC Name: 3-chloro-N'-sulfamoylpropanimidamide | CAS Registry Number: 106649-95-0
Synonyms: ST51001065, 3-chloro-N'-sulfamoylpropanimidamide, AC1NWMNZ, PRO033, N-Sulfamoyl-3-chloropropionamidine, 3-Chloro-N-sulfamoylpropanimidamide, AKOS006294949, AK115631, R861, (1Z)-2-amino-4-chloro-1-azabut-1-enesulfonamide

Molecular Formula:	C₃H₈ClN₃O₂S	Molecular Weight:	185.632520 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: QZFCNUHDVLMXDA-UHFFFAOYSA-N

• Natamycin

Synonyms: pimaricin, NATAMYCIN, Natamycin preparation, Pimaricin preparation, MLS000759475, P0440_SIGMA, P9703_SIGMA, 80482_FLUKA, SMR000466358, (1R,3S,5R,7R,8E,12R,14E,16E,18E,20E,22R,24S,25R,26S)-22-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,26-trihydroxy-12-methyl-10-oxo-6,11,28-trioxatricyclo[22.3.1.0~5,7~]octacosa-8,14,16,18,20-pentaene-25-carboxylic acid

Molecular Formula:	C₃₃H₄₇NO₁₃	Molecular Weight:	665.725180 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	14

InChIKey: NCXMLFZGDNKEPB-FFPOYIOWSA-N

• Nisin

Synonyms: NISIN, NSC112903

Molecular Formula:	C₁₄₃H₂₃₀N₄₂O₃₇S₇	Molecular Weight:	3354.070500 [g/mol]
H-Bond Donor:	41	H-Bond Acceptor:	43

InChIKey: VOSQDGQTENUVIE-INNOLEBESA-N

• O-Chlorophenyl Cyclopenty Ketone

IUPAC Name: (2-chlorophenyl)-cyclopentylmethanone | CAS Registry Number: 6740-85-8
Synonyms: 2-Chlorophenyl cyclopentyl ketone, o-Chlorophenyl cyclopentyl ketone, EINECS 229-802-0, SBB008400, ZINC00156578, FR-1364

Molecular Formula:	C₁₂H₁₃ClO	Molecular Weight:	208.684020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: QIJMMRNZBJHXRI-UHFFFAOYSA-N

• Ondansetron Hcl

IUPAC Name: 9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one dihydrate hydrochloride | CAS Registry Number: 103639-04-9
Synonyms: Zofran, Zensana, Zofrene, Zophren, Yatrox, Zofran Zydis, Zofran ODT, Zofran (TN), ONDANSETRON HYDROCHLORIDE, C18H19N3O.HCl, Ondansetron hydrochloride dihydrate, ZOFRAN PRESERVATIVE FREE, Ondansetron hydrochloride hydrate, Ondansetron hydrochloride [USAN:JAN], ZOFRAN IN PLASTIC CONTAINER, CID59774, EUR-1025, GG-032, GR-38032F, SN-307

Molecular Formula:	C₁₈H₂₄ClN₃O₃	Molecular Weight:	365.854460 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: VRSLTNZJOUZKLX-UHFFFAOYSA-N

• Ondansetron Hydrochloride Dihydrate

IUPAC Name: 9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one hydrochloride | CAS Registry Number: 99614-01-4
Synonyms: Zofran, Zophren, Zudan, Zofran ODT, ONDANSETRON HCl, Ambap5351, ONDANSETRON HYDROCHLORIDE, MLS001304076, MLS001401397, GR 38032F, Ondansetron hydrochloride dihydrate, SN 307, NSC665799, NSC 665799, CPD000469179, LS-51879, SAM001246631, SMR000469179, FE6373975, TL8000158

Molecular Formula:	C₁₈H₂₀ClN₃O	Molecular Weight:	329.823900 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MKBLHFILKIKSQM-UHFFFAOYSA-N

• P-Chloro Benzene Sulphonyl Chloride

IUPAC Name: 4-chlorobenzenesulfonyl chloride | CAS Registry Number: 98-60-2
Synonyms: 4-Chlorobenzenesulfonyl chloride, p-Chlorbenzensulfochlorid, p-Chlorophenylsulfonyl chloride, WLN: WSGR DG, Benzenesulfonyl chloride, p-chloro-, Benzenesulfonyl chloride, 4-chloro-, p-Chlorobenzenesulfonyl chloride, 4-Chlorobenzenesulphonyl chloride, HSDB 5318, p-Chlorbenzensulfochlorid [Czech], 133698_ALDRICH, NSC 6956, 23600_FLUKA, EINECS 202-685-3, NSC6956, 4-CHLOROPHENYLSULFONYL CHLORIDE, Chlorid kyseliny p-chlorbensulfonove, BRN 0511583, Benzenesulfonic acid, 4-chloro-, chloride, Chlorid kyseliny p-chlorbensulfonove [Czech]

Molecular Formula:	C₆H₄Cl₂O₂S	Molecular Weight:	211.065760 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: ZLYBFBAHAQEEQQ-UHFFFAOYSA-N

• P-Hydroxy Valerophenone

IUPAC Name: 1-(4-hydroxyphenyl)pentan-1-one | CAS Registry Number: 2589-71-1
Synonyms: p-Valerylphenol, 4-Valerylphenol, p-Hydroxyvalerophenone, 4'-Hydroxyvalerophenone, Valerophenone, 4'-hydroxy-, ChemDiv3_014404, 1-Pentanone, 1-(4-hydroxyphenyl)-, MLS000522198, 245143_ALDRICH, NSC49186, NSC49321, EINECS 219-978-7, NSC 49186, NSC 49321, ZINC01681257, IDI1_030202, SMR000132606, AI3-11694, ST5405539, EU-0033275

Molecular Formula:	C₁₁H₁₄O₂	Molecular Weight:	178.227660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ZKCJJGOOPOIZTE-UHFFFAOYSA-N

• Para Chloro Benzene Sulphonyl Chloride

IUPAC Name: chlorobenzene;sulfuryl dichloride

Molecular Formula:	C₆H₅Cl₃O₂S	Molecular Weight:	247.514 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: ZMCOWIJJSXOLAZ-UHFFFAOYSA-N

• Purine

IUPAC Name: 7H-purine | CAS Registry Number: 120-73-0
Synonyms: 9H-Purine, 7H-Purine, Isopurine, 1H-Purine, beta-Purine, purine-ring, .beta.-Purine, 3H-purine, 9H-Purine (VAN), 1H-Purine (9CI), Imidazo(4,5-d)pyrimidine, 3,5,7-TRIAZAINDOLE, 7H-Imidazo(4,5-d)pyrimidine, Imidazo[4,5-d]pyrimidine, NSC 753, 6H-Imidazo(4,5-d)pyrimidine, P55805_ALDRICH, P1655_SIGMA, 6H-Imidazo[4,5-d]pyrimidine, 7H-Imidazo[4,5-d]pyrimidine

Molecular Formula:	C₅H₄N₄	Molecular Weight:	120.112060 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: KDCGOANMDULRCW-UHFFFAOYSA-N

• Quinoline

IUPAC Name: quinoline | CAS Registry Number: 91-22-5
Synonyms: QUINOLINE, Chinoline, Leucol, Benzopyridine, Chinoleine, Quinolin, Leukol, 1-Benzazine, 1-Azanaphthalene, Chinolin, Leucoline, Benzo[b]pyridine, 2,3-Benzopyridine, Benzo(b)pyridine, Chinolin [Czech], 1-Benzine, Benzopyridine (VAN), USAF EK-218, CCRIS 547, FEMA No. 3470

Molecular Formula:	C₉H₇N	Molecular Weight:	129.158580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: SMWDFEZZVXVKRB-UHFFFAOYSA-N

• Sertraline Hydrochloride

IUPAC Name: (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride | CAS Registry Number: 79559-97-0
Synonyms: Zoloft, sertraline, Gladem, Serad, Sertraline hydrochloride, Atruline, Tresleen, Tatig, Lustral, Serlift, Aremis, Sertraline.HCl, Zoloft (TN), Ambap2474, C17H17Cl2N.HCl, Sertraline hydrochloride [USAN], MLS000758929, MLS001401398, S6319_SIGMA, SPECTRUM1505262

Molecular Formula:	C₁₇H₁₈Cl₃N	Molecular Weight:	342.690520 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: BLFQGGGGFNSJKA-XHXSRVRCSA-N

• Sodium Percarbonate

IUPAC Name: tetrasodium hydrogen peroxide dicarbonate | CAS Registry Number: 15630-89-4
Synonyms: Oxyper, Perdox, Sodium percarbonate, FB Sodium percarbonate, Peroxy sodium carbonate, Sodium carbonate peroxide, 371432_ALDRICH, EINECS 239-707-6, Disodium carbonate, hydrogen peroxide (2:3), Hydrogen peroxide sodium carbonate adduct, LS-51985, disodium carbonate hydrogen peroxide (2:3), Disodium carbonate, compound with hydrogen peroxide (2:3), Carbonic acid disodium salt, compd. with hydrogen peroxide (H2O2) (2:3), Carbonic acid, disodium salt, compd. with hydrogen peroxide (2:3), 121525-84-6, 205368-25-8, 81677-18-1, 82728-90-3, 89140-31-8

Molecular Formula:	C₂H₆Na₄O₁₂	Molecular Weight:	314.020920 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	12

InChIKey: MSLRPWGRFCKNIZ-UHFFFAOYSA-J

• Sodium Pyrithione

IUPAC Name: sodium 1-oxidopyridine-2-thione | CAS Registry Number: 3811-73-2
Synonyms: Omadine sodium, Sodium pyrithione, Thione (reagent), Prestwick_78, Pyrithione sodium salt, Sodium omadine (VAN), Sodium pyrithione (VAN), Sodium 2-pyridinethiol N-oxide, Sodium 2-pyridinethiol 1-oxide, Sodium (2-pyridylthio)-N-oxide, H3261_SIGMA, 2-Pyridinethiol-1-oxide sodium salt, Sodium 2-mercaptopyridine 1-oxide, Sodium 2-pyridinethiolate 1-oxide, 1-Oxo-2-pyridinethiol sodium salt, NSC 4483, 2-Pyridinethiol N-oxide sodium salt, 63846_FLUKA, EINECS 223-296-5, 2-Mercaptopyridine oxide sodium salt

Molecular Formula:	C₅H₄NNaOS	Molecular Weight:	149.146130 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: XNRNJIIJLOFJEK-UHFFFAOYSA-N

• Sultopride Hydrochloride

IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxybenzamide hydrochloride | CAS Registry Number: 23694-17-9
Synonyms: Barnetil, Sultopride, Sultopride HCl, sultopride hydrochloride, Barnetil (TN), Sultopride monohydrochloride, Sultopride hydrochloride (JAN), MolPort-003-986-646, 53583-79-2 (Parent), EINECS 245-829-0, CID3082221, TL8001960, D02208, N-((1-Ethyl-2-pyrrolidinyl)methyl)-5-(ethylsulphonyl)-2-methoxybenzamide monohydrochloride

Molecular Formula:	C₁₇H₂₇ClN₂O₄S	Molecular Weight:	390.925280 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: IGOWMQPOGQYFFM-UHFFFAOYSA-N

• Temozolomide

IUPAC Name: 3-methyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide | CAS Registry Number: 85622-93-1
Synonyms: temozolomide, Methazolastone, Temodal, Temodar, Temozolamide, Temozolomidum [Latin], Temozolodida [Spanish], Temodal (TN), Temozolomide [BAN:INN], Temozolomide [INN:BAN], Essex brand of temozolomide, CCRG 81045, CCRG-81045, Sch 52365, MLS000759447, MLS001424028, Schering brand of temozolomide, C6H6N6O2, CCRIS 8996, Temozolomide (JAN/USAN/INN)

Molecular Formula:	C₆H₆N₆O₂	Molecular Weight:	194.150840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: BPEGJWRSRHCHSN-UHFFFAOYSA-N

• Triphenylamine

IUPAC Name: N,N-di(phenyl)aniline | CAS Registry Number: 603-34-9
Synonyms: N,N-Diphenylaniline, TRIPHENYLAMINE, Triphenyl amine, Amine, triphenyl, Benzenamine, N,N-diphenyl-, N,N-Diphenylbenzenamine, N,N,N-Triphenylamine, CCRIS 4887, T81604_ALDRICH, HSDB 2098, EINECS 210-035-5, NSC 66458, CID11775, NSC66458, AI3-17278, LS-1437, ST5406126, 149006-34-8, InChI=1/C18H15N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15

Molecular Formula:	C₁₈H₁₅N	Molecular Weight:	245.318400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ODHXBMXNKOYIBV-UHFFFAOYSA-N

• Tris-(4-bromophenyl)amine

IUPAC Name: 4-bromo-N,N-bis(4-bromophenyl)aniline | CAS Registry Number: 4316-58-9
Synonyms: Tris(4-bromophenyl)amine, Tris(p-bromophenyl)amine, p,p',p''-Tribromotriphenylamine, 230219_ALDRICH, NSC86666, ZINC01556318, Triphenylamine, 4,4',4''-tribromo-, ST5410964, Benzenamine, 4-bromo-N,N-bis(4-bromophenyl)-, 24964-91-8

Molecular Formula:	C₁₈H₁₂Br₃N	Molecular Weight:	482.006580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZRXVCYGHAUGABY-UHFFFAOYSA-N

• Venlafaxine HCL

IUPAC Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol hydrochloride | CAS Registry Number: 99300-78-4
Synonyms: Effexor, Effexor XR, venlafaxine, Trevilor, Dobupal, Efectin, Vandral, Efexor, Venlafaxine EA, Venlafaxin HCL, Venlafaxine hydrochloride, Effexor LP, Effexor XL, VENLAFAXINE HCl, Effexor (TN), C17H27NO2.HCl, HSDB 6699, MLS001401454, Venlafaxine hydrochloride [USAN], Wy-45030

Molecular Formula:	C₁₇H₂₈ClNO₂	Molecular Weight:	313.862720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: QYRYFNHXARDNFZ-UHFFFAOYSA-N

• Zinc Omadine

IUPAC Name: zinc 1-oxidopyridin-1-ium-2-thiolate | CAS Registry Number: 13463-41-7
Synonyms: Zinc pyrithione, Zincpolyanemine, Zinc pyrethion, Sebulon Shampoo, Omadine Zinc, Wella Crisan, Top Brass, Vancide P, Zinc pt, Zinci pyrithionum, Finecide ZPT, Hokucide ZPT, Niccanon SKT, Vancide ZP, Biocut ZP, Zinc - pyrion, Zinc pyridinethione, ZnPT, Head and Shoulders, Zn - pyrion

Molecular Formula:	C₁₀H₈N₂O₂S₂Zn	Molecular Weight:	317.721720 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: OTPSWLRZXRHDNX-UHFFFAOYSA-L

• 4-Hydroxyindole

IUPAC Name: 1H-indol-4-ol | CAS Registry Number: 2380-94-1
Synonyms: Hydroxyindole, 4-Indolol, 1H-Indol-4-ol, 4-hydroxyindole, 18, 219878_ALDRICH, EINECS 219-177-2, ZINC00153008, F2313G1, SDCCGMLS-0065859.P001, ST5330636, TL8001968, C02040, H-6000, H-6010

Molecular Formula:	C₈H₇NO	Molecular Weight:	133.147280 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: NLMQHXUGJIAKTH-UHFFFAOYSA-N

• 4-Azaindole

IUPAC Name: 1H-pyrrolo[3,2-b]pyridine | CAS Registry Number: 272-49-1
Synonyms: 4-AZAINDOLE, 1,4-Diazaindene, Ambad403, 1H-Pyrrolo(3,2-b)pyridine, BRN 0109683, CID9226, LS-139468, TL8002199, A-9485, 5-23-06-00303 (Beilstein Handbook Reference)

Molecular Formula:	C₇H₆N₂	Molecular Weight:	118.135940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: XWIYUCRMWCHYJR-UHFFFAOYSA-N