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Hallochem Group Co.,Ltd

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Address: 17F, Venus Science Incubate Center, No.60 Xingguang Road New North Zone, Chongqing, ShenZhen 518005, China
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Profile: Hallochem Group Co.,Ltd. manufactures pharmaceutical intermediates for bio-chemicals, surfactants and special chemicals. We provide kallidinogenase, deoxyribonuclease, chymotrypsin, streptokinase, lysostaphin, trypsin, elastase, aprotinin and urokinase.

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• Enzymes
IUPAC Name: N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide;hydrochloride

Molecular Formula: C16H22Cl2N2O2SMolecular Weight: 377.324 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: OMMOSRLIFSCDBL-UHFFFAOYSA-N

• Epalrestat
IUPAC Name: 2-[(5Z)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid | CAS Registry Number: 82159-09-9
Synonyms: epalrestat, Kinedak, Epalrestat [INN], Epalrestatum [Latin], Kinedak (TN), Epalrestat (JAN/INN), Ono 2235, Ono-2235, ONO 2, ONO-2, MLS000806985, C15H13NO3S2, SBB015450, NCGC00164613-01, SMR000414799, LS-151103, D01688, 3-carboxymethyl-5-(methyl-3-phenylpropenylidene)rhodanine, 5-((Z,E)-beta-Methylcinnamylidene)-4-oxo-2-thioxo-3-thiazolidineacetic acid, 3-Thiazolidineacetic acid, 5-(2-methyl-3-phenyl-2-propenylidene)-4-oxo-2-thioxo-, (E,E)-

Molecular Formula: C15H13NO3S2Molecular Weight: 319.398620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CHNUOJQWGUIOLD-NFZZJPOKSA-N

• Eperisone
IUPAC Name: 1-(4-ethylphenyl)-2-methyl-3-piperidin-1-ylpropan-1-one | CAS Registry Number: 64840-90-0
Synonyms: eperisone, Eperisonum, Esorubicine, Esorubicinum, Eperisona, (+-)-Eperisone, Eperisone [INN], Eperisonum [INN-Latin], Eperisona [INN-Spanish], Esorubicine [INN-French], Esorubicinum [INN-Latin], C17H25NO, CID3236, BRN 1246496, 4'-Ethyl-2-methyl-3-piperidinopropiophenone, NCGC00167973-01, LS-122997, 1-(4-Ethylphenyl)-2-methyl-3-(1-piperidinyl)-1-propanone, 1-Propanone, 1-(4-ethylphenyl)-2-methyl-3-(1-piperidinyl)-, 1-(4-ethylphenyl)-2-methyl-3-(piperidin-1-yl)propan-1-one

Molecular Formula: C17H25NOMolecular Weight: 259.386500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SQUNAWUMZGQQJD-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: C27H29NO11Molecular Weight: 543.519260 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 12

InChIKey: AOJJSUZBOXZQNB-VTZDEGQISA-N

• Epristeride
IUPAC Name: (8S,9S,10R,13S,14S,17S)-17-(tert-butylcarbamoyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid | CAS Registry Number: 119169-78-7
Synonyms: Ono-9302, Epristeride [USAN:BAN:INN], Epristeride (JAN/USAN/INN), ONO 9302, C25H37NO3, SKF 105657, CID68741, SK&F-105657, SK&F 105657, LS-19325, D01134, 17-beta-N-t-Butylcarboxamide-androst-3,5-diene-3-carboxylic acid, 17beta-(tert-Butylcarbamoyl)androsta-3,5-diene-3-carboxylic acid, 17-N-t-butylcarboxamide androst-3,5-diene-3-carboxylic acid, (17-beta)-17-(((1,1-Dimethylethyl)amino)carbonyl)androsta-3,5-diene-3-carboxylic acid, Androsta-3,5-diene-3-carboxylic acid, 17-(((1,1-dimethylethyl)amino)carbonyl)-, (17beta)-, Androsta-3,5-diene-3-carboxylic acid, 17-(((1,1-dimethylethyl)amino)carbonyl)-, (17-beta)-

Molecular Formula: C25H37NO3Molecular Weight: 399.566180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VAPSMQAHNAZRKC-PQWRYPMOSA-N

• Erdosteine
IUPAC Name: 2-[2-oxo-2-[(2-oxothiolan-3-yl)amino]ethyl]sulfanylacetic acid | CAS Registry Number: 84611-23-4
Synonyms: Vectrine, Edirel, Dithiosteine, Esteclin, Dostein, Erdotin, Mucotec, Tussol, Erdosteine [INN], Erdosteinum [Latin], Erdosteine (INN), Mucotec (TN), Zambon brand of erdosteine, Lakeside brand of erdosteine, RV 144, RV-144, C8H11NO4S2, Pharma 2000 brand of erdosteine, PV 144, Glaxo Wellcome brand of erdosteine

Molecular Formula: C8H11NO4S2Molecular Weight: 249.307240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QGFORSXNKQLDNO-UHFFFAOYSA-N

• Estradiol Benzoate
IUPAC Name: [(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate | CAS Registry Number: 50-50-0
Synonyms: estradiol benzoate, Benzhormovarine, Benzoestrofol, Diffollisterol, Difolliculine, Benovocylin, Benzofoline, Femestrone, Follicormon, Gynecormone, Gynformone, Hidroestron, Hormogynon, Unistradiol, Follidrin, Graafina, Solestro, De graafina, Benzo-Gynoestryl, Ovasterol-B

Molecular Formula: C25H28O3Molecular Weight: 376.488020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UYIFTLBWAOGQBI-BZDYCCQFSA-N

• Estriol
IUPAC Name: (8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol | CAS Registry Number: 50-27-1
Synonyms: estriol, Oestriol, Estratriol, Tridestrin, Ovestrion, Ovestin, Trihydroxyestrin, Aacifemine, Oestratriol, Oestriolum, Destriol, Overstin, Orestin, Theelol, Thulol, Hemostyptanon, Ortho-Gynest, Orgastyptin, Stiptanon, Synapause

Molecular Formula: C18H24O3Molecular Weight: 288.381360 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: PROQIPRRNZUXQM-ZXXIGWHRSA-N

• Estropipate
IUPAC Name: [(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate; piperazine | CAS Registry Number: 7280-37-7
Synonyms: Ogen, Estropipate (USP), Ogen (TN), MLS002153957, SMR001233296, D00948, 17-oxoestra-1,3,5(10)-trien-3-yl hydrogen sulfate - piperazine (1:1)

Molecular Formula: C22H32N2O5SMolecular Weight: 436.564880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: HZEQBCVBILBTEP-ZFINNJDLSA-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: C2H6Na2O7P2Molecular Weight: 249.991902 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: GWBBVOVXJZATQQ-UHFFFAOYSA-L

• Exalamide
IUPAC Name: 2-hexoxybenzamide | CAS Registry Number: 53370-90-4
Synonyms: exalamide, Hyperan, o-Hexyloxybenzamide, 2-Hexyloxybenzamide, 2-n-Hexyloxybenzamide, o-(Hexyloxy)benzamide, 2-(Hexyloxy)benzamide, Exalamide [INN:JAN], Exalamidum [INN-Latin], Exalamida [INN-Spanish], Spectrum_001729, Exalamide (JAN/INN), Benzamide, 2-(hexyloxy)-, Spectrum2_000869, Spectrum5_001095, BENZAMIDE, o-HEXYLOXY-, KBioSS_002209, DivK1c_000140, SPECTRUM1503403, SPBio_000917

Molecular Formula: C13H19NO2Molecular Weight: 221.295460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CKSJXOVLXUMMFF-UHFFFAOYSA-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: C20H24O2Molecular Weight: 296.403360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BFYIZQONLCFLEV-DAELLWKTSA-N

• Exifone
IUPAC Name: (2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone | CAS Registry Number: 52479-85-3
Synonyms: Adlone, EXIFONE, 4-Galloylpyrogallol, Exifone [INN], Exifonum [INN-Latin], Exifona [INN-Spanish], EINECS 257-945-9, NSC680919, AIDS060880, NSC 680919, AIDS-060880, C13H10O7, CID40399, BRN 3401917, 2,3,3',4,4',5'-Hexahydroxybenzophenone, ZINC03775294, LS-91331, hexahydro-2,3,4,3',4',5'-benzophenone, 3-08-00-04364 (Beilstein Handbook Reference), (2,3,4-Trihydroxyphenyl)(3,4,5-trihydroxyphenyl)methanone

Molecular Formula: C13H10O7Molecular Weight: 278.214300 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 7

InChIKey: XEDWWPGWIXPVRQ-UHFFFAOYSA-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: C14H19N5O4Molecular Weight: 321.331760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: GGXKWVWZWMLJEH-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: C8H15N7O2S3Molecular Weight: 337.445400 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 9

InChIKey: XUFQPHANEAPEMJ-UHFFFAOYSA-N

• Fasudil Hydrochloride
IUPAC Name: 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline hydrochloride | CAS Registry Number: 105628-07-7
Synonyms: Fasudil hydrochloride, Fasudil, Fasdil, Eril, AT 877 hydrochloride, HA 1077 hydrochloride, Fasudil hydrochloride (JAN), C14H17N3O2S.HCl, MLS000069344, ha-1077, HA-1077 DIHYDROCHLORIDE, AT-877, CID163751, NCGC00180915-01, LS-60222, SMR000058993, D01840, 1H-1,4-Diazepine, hexahydro-1-(5-isoquinolinylsulfonyl)-, monohydrochloride, Hexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochloride, 133337-43-6

Molecular Formula: C14H18ClN3O2SMolecular Weight: 327.829620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: LFVPBERIVUNMGV-UHFFFAOYSA-N

• Felbamate
IUPAC Name: (3-carbamoyloxy-2-phenylpropyl) carbamate | CAS Registry Number: 25451-15-4
Synonyms: felbamate, Felbatol, Felbamyl, Taloxa, Felbamatum [Latin], Felbamato [Spanish], Felbatol (TN), Felbamate [USAN:INN], Tocris-0869, Felbamate (USAN/INN), Prestwick0_000919, Lopac-F-0778, Biomol-NT_000203, Lopac0_000524, 2-Phenyl-1,3-propanediol dicarbamate, MLS000028465, MLS000758238, MLS001077299, F0778_SIGMA, BPBio1_001258

Molecular Formula: C11H14N2O4Molecular Weight: 238.239860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WKGXYQFOCVYPAC-UHFFFAOYSA-N

• Felodipine
IUPAC Name: 3-O-ethyl 5-O-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 72509-76-3
Synonyms: felodipine, Plendil, Perfudal, Munobal, Flodil, Modip, Splendil, Renedil, Prevex, Hydac, Agon, dl-Felodipine, Felogard, Feloday, Penedil, Preslow, Lexxel, Munobal Retard, Plendil Retard, Plendil Depottab

Molecular Formula: C18H19Cl2NO4Molecular Weight: 384.253760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RZTAMFZIAATZDJ-UHFFFAOYSA-N

• Fenoldopam
IUPAC Name: 6-chloro-1-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol | CAS Registry Number: 67227-56-9
Synonyms: fenoldopam, Corlopam, Fenoldopamum [Latin], Fenodopam mesylate, Fenoldopam bromide, Fenoldopam [INN:BAN], FENOLDOPAM MESYLATE, Biomol-NT_000042, C16H16ClNO3, Lopac0_000556, BPBio1_001265, CHEBI:5002, CID3341, SKF 82526, SKF-82526J, SK&F-82526J, PDSP1_001661, PDSP2_001645, SKF-82526, DB00800

Molecular Formula: C16H16ClNO3Molecular Weight: 305.756140 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: TVURRHSHRRELCG-UHFFFAOYSA-N

• Fenticonazole nitrate
IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]imidazole; nitric acid | CAS Registry Number: 73151-29-8
Synonyms: Lomexin, Falvin, FENTICONAZOLE NITRATE, Lomexin (TN), Fenticonazole mononitrate, fenticonazole mononitate, Fenticonazole nitrate [USAN], Rec-151476B free base, Fenticonazole nitrate (USAN), C24H20Cl2N2OS.HNO3, EINECS 277-302-6, Rec-151476, CID51754, REC 15/1476, LS-78412, D02583, (+-)-1-(2,4-Dichloro-beta-((p-(phenylthio)benzyl)oxy)phenethyl)imidazole mononitrate, 1-(2-(2,4-Dichlorophenyl)-2-((4-(phenylthio)phenyl)methoxy)ethyl)-1H-imidazolium nitrate, alpha-(2,4-Dichlorophenyl)-beta,N-imidazolylethyl-4-phenylthiobenzyl ether nitrate, Imidazole, 1-(2,4-dichloro-beta-(p-(phenylthio)benzyloxy)phenethyl)-, nitrate

Molecular Formula: C24H21Cl2N3O4SMolecular Weight: 518.412240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: FJNRUWDGCVDXLU-UHFFFAOYSA-N

• Fexofenadine
IUPAC Name: 2-[4-[1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid | CAS Registry Number: 83799-24-0
Synonyms: fexofenadine, Carboxyterfenadine, Terfenadine-COOH, Fexofendine, Terfenadine carboxylate, Terfenadine acid metabolite, Spectrum_001914, Spectrum2_001179, Spectrum3_001921, Spectrum4_000204, Spectrum5_001474, Fexofenadine [INN:BAN], FEXOFENADINE HYDROCHLORIDE, Lopac0_000488, BSPBio_003521, KBioGR_000807, KBioSS_002456, SPBio_001197, C32H39NO4, HSDB 7486

Molecular Formula: C32H39NO4Molecular Weight: 501.656360 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RWTNPBWLLIMQHL-UHFFFAOYSA-N

• Flecainide
IUPAC Name: N-(piperidin-2-ylmethyl)-2,5-bis(2,2,2-trifluoroethoxy)benzamide | CAS Registry Number: 54143-55-4
Synonyms: flecainide, Flecaine, Tambocor, Flecainide acetate, (+-)-Flecainide, Flecainidum [INN-Latin], Flecainida [INN-Spanish], Flecainide [INN:BAN], Prestwick0_000735, Prestwick1_000735, Prestwick2_000735, Prestwick3_000735, CCRIS 313, FLECAINIDE MONOACETATE, Lopac0_000546, BSPBio_000690, BSPBio_001317, KBioGR_000037, KBioSS_000037, SPBio_002629

Molecular Formula: C17H20F6N2O3Molecular Weight: 414.342719 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: DJBNUMBKLMJRSA-UHFFFAOYSA-N

• Fleroxacin
IUPAC Name: 6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid | CAS Registry Number: 79660-72-3
Synonyms: fleroxacin, Megalone, Megalocin, Fleroxicin, Megalosin, Quinodis, Megalocin (TN), Fleroxacine [French], Fleroxacinum [Latin], Megalone (TN), Fleroxacino [Spanish], FLRX, CCRIS 3972, MLS000759401, Fleroxacin (JAN/USAN/INN), AM-833, 33930_RIEDEL, Fleroxacin [USAN:BAN:INN:JAN], CID3357, AM 833

Molecular Formula: C17H18F3N3O3Molecular Weight: 369.338330 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: XBJBPGROQZJDOJ-UHFFFAOYSA-N

• Flomoxef
IUPAC Name: (6R,7R)-7-[[2-(difluoromethylsulfanyl)acetyl]amino]-3-[[1-(2-hydroxyethyl)tetrazol-5-yl]sulfanylmethyl]-7-methoxy-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 99665-00-6
Synonyms: Flomoxef [INN], Flomoxefum [Latin], Flomoxefo [Spanish], S 6315, (-)-(6R,7R)-7-(2-((Difluoromethyl)thio)acetamido)-3-(((1-(2-hydroxyethyl)-1H-tetrazol-5-yl)thio)methyl)-7-methoxy-8-oxo-5-oxa-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid

Molecular Formula: C15H18F2N6O7S2Molecular Weight: 496.466226 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 13

InChIKey: UHRBTBZOWWGKMK-DOMZBBRYSA-N

• Florfenicol
IUPAC Name: 2,2-dichloro-N-[(1R,2S)-3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide | CAS Registry Number: 76639-94-6
Synonyms: Nuflor, florphenicol, (-)-Florfenicol, Nuflor (TN), 3-fluorothiamphenicol, thiamphenicol, 3-fluoro, Prestwick0_000955, Prestwick1_000955, Prestwick2_000955, Prestwick3_000955, Florfenicol (USAN/INN), Sch-25298, C12H14Cl2FNO4S, Sch 25298, BSPBio_000950, MLS002154071, SPBio_003099, Florfenicol [USAN:INN:BAN], BPBio1_001046, CID114811

Molecular Formula: C12H14Cl2FNO4SMolecular Weight: 358.213263 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: AYIRNRDRBQJXIF-NXEZZACHSA-N

• Flubendazole
IUPAC Name: methyl N-[6-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate | CAS Registry Number: 31430-15-6
Synonyms: Fluvermal, Flubenol, Flumoxal, Flumoxane, fluoromebendazole, Flubendazol, Flumoxanal, Flicum, Ambap6379, Flubendazol [INN-Spanish], Flubendazolum [INN-Latin], Flubendazole (USAN/INN), CCRIS 4480, Flubendazole [USAN:BAN:INN], MLS000759477, MLS001424042, 34091_RIEDEL, C16H12FN3O3, EINECS 250-624-4, NSC313680

Molecular Formula: C16H12FN3O3Molecular Weight: 313.283183 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: CPEUVMUXAHMANV-UHFFFAOYSA-N

• Fluconazole
IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol | CAS Registry Number: 86386-73-4
Synonyms: fluconazole, Triflucan, Diflucan, Biozolene, Elazor, Biocanol, Fungata, Zonal, Alflucoz, Flucazol, Flukezol, Flunizol, Oxifugol, Pritenzol, Afungil, Cryptal, Dimycon, Fluzone, Canzol, Forcan

Molecular Formula: C13H12F2N6OMolecular Weight: 306.270786 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: RFHAOTPXVQNOHP-UHFFFAOYSA-N

• 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: C10H13FN5O7PMolecular Weight: 365.211684 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 13

InChIKey: GIUYCYHIANZCFB-FJFJXFQQSA-N

• Fludarabine (base)
IUPAC Name: (2R,3S,4S,5R)-2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol | CAS Registry Number: 21679-14-1
Synonyms: Fludarabine, fludara, FaraA, SQ Fludarabine, 2-Fluoro Ara-A, Fludarabinum [Latin], Fludarabina [Spanish], F-Ara-A, Fludarabine [INN], fludarabine phosphate, 2-F-ara-A, CCRIS 3382, HSDB 6964, MLS000028687, C10H12FN5O4, EINECS 244-525-5, NSC 118218H, NSC 118218, 9-beta-D-Arabinosyl-2-fluoroadenine, 2-Fluoro-9-beta-D-arabinofuranosyladenine

Molecular Formula: C10H12FN5O4Molecular Weight: 285.231783 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: HBUBKKRHXORPQB-FJFJXFQQSA-N

• flunixin meglumine
IUPAC Name: (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol; 2-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid | CAS Registry Number: 42461-84-7
Synonyms: Banamine, finadyne, FLUNIXIN MEGLUMINE, Banamine (TN), Banamine (Veterinary), Sch 14714 meglumine, Flunixin N-methylglucanine, Sch-14714 meglumine, Flunixin Meglumine [USAN], Flunixin meglumine (USP), BSPBio_002558, MLS001333159, MLS002153985, F0429_SIGMA, SPECTRUM1505113, EINECS 255-836-0, C14H11F3N2O2.C7H17NO5, NCGC00180889-01, LS-71360, SMR000875279

Molecular Formula: C21H28F3N3O7Molecular Weight: 491.458130 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 13

InChIKey: MGCCHNLNRBULBU-WZTVWXICSA-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: C17H18F3NOMolecular Weight: 309.326130 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RTHCYVBBDHJXIQ-UHFFFAOYSA-N

• Flupirtine
IUPAC Name: (Z)-but-2-enedioic acid; ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]pyridin-3-yl]carbamate | CAS Registry Number: 56995-20-1
Synonyms: Flupirtine maleate, Katadolon, Effirma, Flupirtin-maleat [German], Flupirtine maleate [USAN], flupirtine maleate (1:1), Flupirtine maleate (USAN), F8927_SIGMA, EINECS 278-225-0, W 2964M, C15H18N4O2.C4H4O4, NCGC00093935-01, LS-48933, EU-0100547, D-9998, D04226, Ethyl 2-amino-6-((p-fluorobenzyl)amino)-3-pyridinecarbamate maleate (1:1), Ethyl-N-(2-amino-6-(4-fluorophenylmethylamino)pyridin-3-yl)carbamate maleate, (2-Amino-6-(((4-fluorophenyl)methyl)amino)-3-pyridinyl)carbamic acid ethyl ester maleate, Ethyl 2-amino-6-((4-fluorobenzyl)amino)pyridine-3-carbamate, compound with maleic acid (1:1)

Molecular Formula: C19H21FN4O6Molecular Weight: 420.391643 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: DPYIXBFZUMCMJM-BTJKTKAUSA-N

• Flutamide
IUPAC Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide | CAS Registry Number: 13311-84-7
Synonyms: flutamide, Eulexin, Niftolide, niftolid, Niftholide, Drogenil, Eulexine, Chimax, Flutandrona, Prostandril, Prostogenat, Flutacell, Flutamin, Flutaplex, Flutexin, Grisetin, NFBA, Prostacur, Prostica, Testotard

Molecular Formula: C11H11F3N2O3Molecular Weight: 276.211850 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: MKXKFYHWDHIYRV-UHFFFAOYSA-N

• Fropenem
IUPAC Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2R)-oxolan-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid | CAS Registry Number: 106560-14-9
Synonyms: faropenem, Fropenem [INN], CHEBI:51257, TL8000237, (+)-(5R,6S)-6-((1R)-1-Hydroxyethyl)-7-oxo-3-((2R)-tetrahydro-2-furyl)-4-thia-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 6alpha-[(R)-1-hydroxyethyl]-2-[(R)-tetrahydrofuran-2-yl]pen-2-em-3-carboxylic acid, (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(2R)-tetrahydrofuran-2-yl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 6alpha-[(1R)-1-hydroxyethyl]-2-[(2R)-tetrahydrofuran-2-yl]-2,3-didehydropenam-3-carboxylic acid, FPM

Molecular Formula: C12H15NO5SMolecular Weight: 285.316200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: HGGAKXAHAYOLDJ-FHZUQPTBSA-N

• Lodine
IUPAC Name: 2-(1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid | CAS Registry Number: 41340-25-4
Synonyms: etodolac, Etodolic acid, Ultradol, Ramodar, Lodine XL, Osteluc, Edolan, Hypen, Acid, Etodolic, Lodine SR, Prestwick_209, Lodine (TN), Ambap772, Etodolacum [INN-Latin], Etodolaco [INN-Spanish], Spectrum_001244, Etodolac, (S)-Isomer, Etodolac, (-)-Isomer, Prestwick0_000231, Prestwick1_000231

Molecular Formula: C17H21NO3Molecular Weight: 287.353540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NNYBQONXHNTVIJ-UHFFFAOYSA-N

• Nitalapram
IUPAC Name: 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile | CAS Registry Number: 59729-33-8
Synonyms: citalopram, Cytalopram, Cipram, Escitalopram, Citadur, Lexapro, [3H]Citalopram, Citadur (TN), Citalopram [Celexa], Citalopramum [INN-Latin], citalopram hydrobromide, Citalopram (USP/INN), Citalopram [BAN:INN], Citalopram [INN:BAN], Prestwick3_000692, Lopac0_000258, BSPBio_000843, BPBio1_000929, C20H21FN2O, CHEBI:3723

Molecular Formula: C20H21FN2OMolecular Weight: 324.391943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WSEQXVZVJXJVFP-UHFFFAOYSA-N

• Peptides

Molecular Formula: C45H36Cl4N6O10Molecular Weight: 962.613540 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 12

InChIKey: ITEJDHVEYLBYQP-DDFLMXQMSA-N

• Sodium Diethyldithiocarbamate
IUPAC Name: sodium N,N-diethylcarbamodithioate | CAS Registry Number: 148-18-5
Synonyms: Dithiocarb, Ditiocarb, Imuthiol, Thiocarb, Cupral, Kupral, Ditiocarb sodium, Na-ddtc, Nocceler SDC, Soxinol ESL, Sodium DEDT, DeDTC, DDTC, DEDC, Ditiocarb sodium [INN], Usaf ek-2596, Diethyldithiocarbamate sodium, Ditiocarbe sodique [French], Ditiocarbo sodico [Spanish], Ditiocarbum natricum [Latin]

Molecular Formula: C5H10NNaS2Molecular Weight: 171.259370 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: IOEJYZSZYUROLN-UHFFFAOYSA-M

• Somatostatin
Synonyms: SOMATOSTATIN, AIDS059774, AIDS-059774

Molecular Formula: C67H95N17O18S2Molecular Weight: 1490.704300 [g/mol]
H-Bond Donor: 21H-Bond Acceptor: 22

InChIKey: IVXKQLNIZABQDV-DOBXHNDVSA-N

• Streptokinase
IUPAC Name: 4-cyclohexylpyrrolidine-2-carboxylic acid | CAS Registry Number: 9002-01-1
Synonyms: ACMC-20airn, 4-cyclohexylpyrrolidine-2-carboxylic Acid, SureCN197230, CTK8G4672, L-Proline,4-cyclohexyl-, (4S)-, AKOS015962191, 4-cyclohexyl-2-pyrrolidinecarboxylic acid, AC-13801, A800690, I01-0884

Molecular Formula: C11H19NO2Molecular Weight: 197.274060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XRZWVSXEDRYQGC-UHFFFAOYSA-N

• Trypsin (CAS: 2594-14-1)
• Urokinase (CAS: 9039-53-6)
• Vigabatrin
IUPAC Name: 4-aminohex-5-enoic acid | CAS Registry Number: 60643-86-9
Synonyms: vigabatrin, Sabril, Vigabatrine, Sabrilex, gamma-Vinyl GABA, gamma-Vinyl-GABA, gamma Vinyl GABA, Vigabatrine [French], Vigabatrinum [Latin], Prestwick_837, Vigabatrina [Spanish], Sabril (TN), 4-Amino-5-hexenoic acid, 4-Aminohexenoic acid, .gamma.-Vinyl-GABA, 4-aminohex-5-enoic acid, Spectrum_000368, SpecPlus_000664, Hexenoic acid, 4-amino, Vigabatrin Aventis Brand

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PJDFLNIOAUIZSL-UHFFFAOYSA-N

• 10-Deacetyl Baccatin III
Synonyms: 10-Deacetylbaccatin III, D3676_SIGMA, STOCK1N-38774, CHEBI:18193, 10-Deacetylbaccatin- III from Taxus baccata, C11700, 5beta,20-epoxy-1,7beta,10beta,13alpha-tetrahydroxy-9-oxotax-11-ene-2alpha,4alpha-diyl 4-acetate 2-benzoate, 7,11-Methano-5H-cyclodeca(3,4)benz(1,2-b)oxet-5-one, 12b-(acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-4,6,9,11-tetrahydroxy-4a,8,13,13-tetramethyl-, (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-

Molecular Formula: C29H36O10Molecular Weight: 544.590140 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: YWLXLRUDGLRYDR-ZHPRIASZSA-N

• 5'-Deoxy-5-FluoroUridine (DFUR, Doxifluridine)
IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoropyrimidine-2,4-dione | CAS Registry Number: 3094-09-5
Synonyms: doxifluridine, Furtulon, Flutron, doxyfluridine, 5'-Doxifluridine, 5'-Deoxy-5-fluorouridine, Furtulon (TN), 5-Fluorodeoxyuridine, 5'-Dfur, 5'dFUrd, 5-fluoro-5'-deoxyuridine, Doxifluridine [INN:JAN], Doxifluridinum [INN-Latin], Doxifluridina [INN-Spanish], 5'FDUR, 5-DFUR, Uridine-5'-deoxy-5-fluoro-, 5'-fluoro-5'-deoxyuridine, Doxifluridine (JP15/INN), Uridine, 5'-deoxy-5-fluoro-

Molecular Formula: C9H11FN2O5Molecular Weight: 246.192443 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: ZWAOHEXOSAUJHY-ZIYNGMLESA-N

• 5-Fluorocytosine
IUPAC Name: 6-amino-5-fluoro-1H-pyrimidin-2-one | CAS Registry Number: 2022-85-7
Synonyms: flucytosine, Fluocytosine, Flucytosin, Ancobon, Fluorcytosine, Ancotil, 5-Fluorocytosin, 5-Fluorocystosine, Alcobon, Fluorocytosine, Flucytosone, Ancotyl, Cytosine, 5-fluoro-, 5-Flurocytosine, 5-FC, Ancobon (TN), Flucitosina [DCIT], Flucytosinum [INN-Latin], 5-Fluorocytosine-6-3H, Prestwick0_000934

Molecular Formula: C4H4FN3OMolecular Weight: 129.092463 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XRECTZIEBJDKEO-UHFFFAOYSA-N

• (4-Amino-1-hydroxy-1-phosphonobutyl)phosphonic acid
IUPAC Name: (4-amino-1-hydroxy-1-phosphonobutyl)phosphonic acid | CAS Registry Number: 66376-36-1
Synonyms: alendronate, ALENDRONIC ACID, Arendal, 1yhm, bisphosphonate, 65, Alendronic acid (INN), ALENDRONATE SODIUM, Acide alendronique [INN-French], Acido alendronico [INN-Spanish], Acidum alendronicum [INN-Latin], Alendronic acid [BAN:INN], Alendronic acid [INN:BAN], Oprea1_422906, SPECTRUM1505166, CHEBI:2567, CID2088, MK 217, AIDS112217, AIDS-112217, (4-Amino-1-hydroxybutylidene)bisphosphonic acid

Molecular Formula: C4H13NO7P2Molecular Weight: 249.096042 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: OGSPWJRAVKPPFI-UHFFFAOYSA-N

• 5-bromo-n-(4,5-dihydro-1h-imidazol-2-yl)-6-quinoxalinamine
IUPAC Name: 5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine | CAS Registry Number: 59803-98-4
Synonyms: brimonidine, Bromoxidine, Alphagan P, Alphagan, Brimonidine (INN), nchembio705-7, Tocris-0425, BRIMONIDINE TARTRATE, Lopac-U-104, Brimonidine [INN:BAN], U104_SIGMA, Lopac0_001216, C11H10BrN5, MLS000069370, MLS001076349, CHEBI:3175, UK 14,304, STOCK6S-47874, CID2435, UK 14304

Molecular Formula: C11H10BrN5Molecular Weight: 292.134600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: XYLJNLCSTIOKRM-UHFFFAOYSA-N

• 2-Piperidinecarboxylic acid, 1-[(2S)-5-[(aminoiminomethyl)amino]-1-oxo-2-[[(1,2,3,4-tetrahydro-3-methyl-8-quinolinyl)sulfonyl]amino]pentyl]-4-methyl-, (2R,4R)-
IUPAC Name: (2R,4R)-1-[5-(diaminomethylideneamino)-2-[(3-methyl-1,2,3,4-tetrahydroquinolin-8-yl)sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylic acid | CAS Registry Number: 74863-84-6
Synonyms: argatroban, NCGC00164592-01, TL8005144, C04931, (2R,4R)-4-Methyl-1[Nalpha-[(3-methyl-1,2,3,4-tetrahydro-8-quinolinyl)sulfonyl]-L-arginyl)]-2-piperadinecarboxylic acid

Molecular Formula: C23H36N6O5SMolecular Weight: 508.634140 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: KXNPVXPOPUZYGB-VSVYTNTFSA-N

• 2,2-Dichloro-N-[(1R,2S)-3-Fluoro-1-Hydroxy-1-(4-Methylsulfonylphenyl)propan-2-Yl]acetamide
IUPAC Name: 2,2-dichloro-N-[(1R,2S)-3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide | CAS Registry Number: 73231-34-2
Synonyms: Florfenicol, Nuflor, florphenicol, (-)-Florfenicol, Nuflor (TN), 3-fluorothiamphenicol, thiamphenicol, 3-fluoro, Prestwick0_000955, Prestwick1_000955, Prestwick2_000955, Prestwick3_000955, Florfenicol (USAN/INN), Sch-25298, Florfenicol [USAN:INN:BAN], C12H14Cl2FNO4S, Sch 25298, BSPBio_000950, MLS002154071, SPBio_003099, BPBio1_001046

Molecular Formula: C12H14Cl2FNO4SMolecular Weight: 358.213263 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: AYIRNRDRBQJXIF-NXEZZACHSA-N


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