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• Amantadine Hydrochloride

IUPAC Name: adamantan-1-amine hydrochloride | CAS Registry Number: 665-66-7
Synonyms: Symmetrel, Influenol, Midantane, Mydantane, Trivaline, Amazolon, Midantan, Amantan, Viregyt, Virosol, amantadine, Amantadine hydrochloride, Symadine, Virofral, Virasol, Amantadine HCl, Adamantine hydrochloride, Symmetrel (TN), 1-Adamantanamine hydrochloride, Adamantanamine hydrochloride

Molecular Formula:	C₁₀H₁₈ClN	Molecular Weight:	187.709620 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: WOLHOYHSEKDWQH-UHFFFAOYSA-N

• Amikacin sulfate salt

IUPAC Name: 4-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide;sulfuric acid | CAS Registry Number: 149022-22-0
Synonyms: CTK8F1342

Molecular Formula:	C₂₂H₄₅N₅O₁₇S	Molecular Weight:	683.681000 [g/mol]
H-Bond Donor:	15	H-Bond Acceptor:	21

InChIKey: HIBICIOPDUTNRR-UHFFFAOYSA-N

• Artemether

Synonyms: Coartem, beta-Artemether, Artemetheri, Artmether, Paluther, Qinghaosu, Artemos, Artenam, Mixture Name, Artemether [INN], Methyl-dihydroartemisinine, Artemetero [INN-Spanish], Artemetherum [INN-Latin], Artemisininelactol methyl ether, Dihydroartemisinin methyl ether, Dihydroquinghaosu methyl ether, MLS001424249, beta-Dihydroartemisinin methyl ether, HSDB 7456, SM 224

Molecular Formula:	C₁₆H₂₆O₅	Molecular Weight:	298.374640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: SXYIRMFQILZOAM-HVNFFKDJSA-N

• Azathioprine

IUPAC Name: 6-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-7H-purine | CAS Registry Number: 446-86-6
Synonyms: azathioprine, Azothioprine, Azathioprin, Azatioprin, Imuran, Rorasul, Azamun, Azanin, Ccucol, Imurek, Imurel, Muran, Cytostatics, Immuran, Azasan, azatiopr in, Azamun [Czech], Azathioprine sodium, Imuran (TN), Prestwick_41

Molecular Formula:	C₉H₇N₇O₂S	Molecular Weight:	277.262580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: LMEKQMALGUDUQG-UHFFFAOYSA-N

• Benserazide Hydrochloride

IUPAC Name: 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide hydrochloride | CAS Registry Number: 14919-77-8
Synonyms: BENSERAZIDE HYDROCHLORIDE, Benzerazide hydrochloride, Madopa (Hoffmann-LaRoche), CCRIS 5092, MLS000028424, MLS001148252, B7283_SIGMA, C10H15N3O5.HCl, SPECTRUM1500137, EINECS 238-991-9, Benserazide hydrochloride (JP15), CID26964, Ro 4-4602/001, NCGC00093698-01, NCGC00093698-02, NCGC00093698-03, NCGC00093698-04, NCGC00093698-05, SMR000058421, LS-145026

Molecular Formula:	C₁₀H₁₆ClN₃O₅	Molecular Weight:	293.704140 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	7

InChIKey: ULFCBIUXQQYDEI-UHFFFAOYSA-N

• bupropion HCl

IUPAC Name: 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one hydrochloride | CAS Registry Number: 31677-93-7
Synonyms: Bupropion hydrochloride, Wellbutrin, Zyban, Wellbutrin SR, Wellbutrin XL, Wellbatrin, Elontril, Quomem, Voxra, Wellbutrin XR, Wellbutrin Retard, Wellbutrin (TN), Prestwick_668, Zyban (pharmaceutical), Amfebutamon hydrochlorid, Zyban (TN), Amfebutamone hydrochloride, B102_SIGMA, HSDB 6988, MLS000069376

Molecular Formula:	C₁₃H₁₉Cl₂NO	Molecular Weight:	276.202060 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: HEYVINCGKDONRU-UHFFFAOYSA-N

• Chloropromazine Hydrochloride

IUPAC Name: 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine hydrochloride | CAS Registry Number: 69-09-0
Synonyms: Sonazine, Chloractil, Klorpromex, Propaphenin, Thorazine, Promacid, Hebanil, Chlorazin, Klorproman, Largactil, Neurazine, Norcozine, Plegomazin, Promachel, Unitensen, Hibernal, Hybernal, Lomazine, Marazine, Promapar

Molecular Formula:	C₁₇H₂₀Cl₂N₂S	Molecular Weight:	355.325100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: FBSMERQALIEGJT-UHFFFAOYSA-N

• Chromium Picolinate

IUPAC Name: chromium(3+); pyridine-2-carboxylate | CAS Registry Number: 14639-25-9
Synonyms: Chromium picolinate, Chromium tripicolinate, Chromium, tris(picolinato)-, Chromium(III) trispicolinate, Picolinic acid, chromium salt, Chromium 2-pyridinecarboxylate, 2-Pyridinecarboxylic acid, chromium salt, CID151932, LS-2230, Chromium, tris(2-pyridinecarboxylato-N(1),O(2))-, CHROMIUM PICOLINATE (SEE ALSO: 27882-76-4), Chromium, tris(2-pyridinecarboxylato-N(1),O(2))- (9CI), 140947-78-0

Molecular Formula:	C₁₈H₁₂CrN₃O₆	Molecular Weight:	418.300480 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	9

InChIKey: CBDQOLKNTOMMTL-UHFFFAOYSA-K

• Cisplatin

IUPAC Name: azane; platinum(2+); dichloride | CAS Registry Number: 15663-27-1
Synonyms: cisplatin, Transplatin, cis-Platinum, Biocisplatinum, Platidiam, Platinol, trans-DDP, platino, Cisplatine, Platiblastin, Abiplatin, Briplatin, Cisplatyl, Neoplatin, Platosin, cis Platinum, cis-Platin, Peyrone's chloride, DDPt, cis-Platinum(II)

Molecular Formula:	Cl₂H₆N₂Pt	Molecular Weight:	300.045040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: LXZZYRPGZAFOLE-UHFFFAOYSA-L

• Citalopram Hydrobromide

IUPAC Name: 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile hydrobromide | CAS Registry Number: 59729-32-7
Synonyms: citalopram hydrobromide, Celexa, citalopram, Nitalapram, Cipramil, Seropram, Apertia, Elopram, Prisdal, Cipram, Lupram, Sepram, Celexa (TN), C20H21FN2O.HBr, Citalopram hydrobromide [USAN], HSDB 7042, MLS000758293, MLS000860078, MLS001401376, C7861_SIGMA

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

InChIKey: WIHMBLDNRMIGDW-UHFFFAOYSA-N

• Clomipramine Hcl

IUPAC Name: 3-(9-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine hydrochloride | CAS Registry Number: 17321-77-6
Synonyms: Anafranil, Clomipramine hydrochloride, Anaphranil, Clomipramine HCL, Prestwick_72, Anafranil (TN), Anafranil hydrochloride, Chlorimipramine hydrochloride, Clomipramine Hydochloride, C19H23ClN2.HCl, 3-Chloroimipramine hydrochloride, Clomipramine Monohydrochloride, Chloroimipramine monohydrochloride, MLS000028511, MLS001074205, C7291_SIGMA, SPECTRUM2300061, EINECS 241-344-3, Clomipramine hydrochloride [USAN:JAN], RJC 01223

Molecular Formula:	C₁₉H₂₄Cl₂N₂	Molecular Weight:	351.313260 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: WIMWMKZEIBHDTH-UHFFFAOYSA-N

• Diosmine

IUPAC Name: 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-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 | CAS Registry Number: 520-27-4
Synonyms: diosmin, Diosmin [INN], Diosmin [INN-Spanish], Diosmine [INN-French], Diosminum [INN-Latin], Diosmetin 7-O-rutinoside, MLS001304032, CCRIS 7915, STOCK1N-14729, AIDS059330, AIDS-059330, EINECS 208-289-7, CID5281613, SMP1_000183, SMR000718616, LS-193056, C10039, 4H-1-Benzopyran-4-one, 7-((6-O-(6-deoxy-.alpha.-L-mannopyranosyl)-.beta.- D-glucopyranosyl)oxy)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-, 4H-1-Benzopyran-4-one, 7-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-

Molecular Formula:	C₂₈H₃₂O₁₅	Molecular Weight:	608.544680 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	15

InChIKey: GZSOSUNBTXMUFQ-YFAPSIMESA-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

• Enrofloxacin

IUPAC Name: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid | CAS Registry Number: 93106-60-6
Synonyms: Baytril, endrofloxicin, Enrofloxacine, Enroxil, CFPQ, Baytril (TN), N-Ethylciprofloxacin, Enrofloxacine [French], Enrofloxacinum [Latin], ERFX, Enrofloxacino [Spanish], Bay-Vp-2674, Enrofloxacin (USAN/INN), Enrofloxacin [USAN:BAN:INN], BAY VP 2674, HSDB 6952, MLS000069441, MLS001076496, SPECTRUM1503721, 33699_RIEDEL

Molecular Formula:	C₁₉H₂₂FN₃O₃	Molecular Weight:	359.394683 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: SPFYMRJSYKOXGV-UHFFFAOYSA-N

• Epinephrine Bitartrate

IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid; 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol | CAS Registry Number: 51-42-3
Synonyms: Asmatane Mist, Medihaler-Epi, Asthmahaler, Suprarenin, Epitrate, Bronitin Mist, Sensorcaine, Duranest, Citanest Forte, Mixture Name, E-Pilo, Epinephrine bitartrate, Adrenaline bitartrate, L-Adrenaline tartrate, l-Epinephrine tartrate, l-Adrenaline bitartrate, Adrenaline acid tartrate, Epinephrine d-bitartrate, l-Epinephrine bitartrate, Asmatane mist (TN)

Molecular Formula:	C₁₃H₁₉NO₉	Molecular Weight:	333.291260 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	10

InChIKey: YLXIPWWIOISBDD-NDAAPVSOSA-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

• 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

• Fenbendazole

IUPAC Name: methyl N-(6-phenylsulfanyl-1H-benzimidazol-2-yl)carbamate | CAS Registry Number: 43210-67-9
Synonyms: fenbendazole, Panacur, Phenbendasol, Fenbendazol, Prestwick_213, Panacur (TN), Hoe 881v, Spectrum_001254, Fenbendazol [INN-Spanish], Fenbendazolum [INN-Latin], Prestwick0_000210, Prestwick1_000210, Prestwick2_000210, Prestwick3_000210, Spectrum2_000040, Spectrum3_000911, Spectrum4_001010, Spectrum5_001359, Fenbendazole (USP/INN), CCRIS 7309

Molecular Formula:	C₁₅H₁₃N₃O₂S	Molecular Weight:	299.347620 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: HDDSHPAODJUKPD-UHFFFAOYSA-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:	C₁₆H₁₂FN₃O₃	Molecular Weight:	313.283183 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: CPEUVMUXAHMANV-UHFFFAOYSA-N

• Fluphenazine Hydrochloride

IUPAC Name: 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethanol dihydrochloride | CAS Registry Number: 146-56-5
Synonyms: Prolixin, Anatensol, Permitil, Moditen, Tensofin, Calmansial, Flufenazin, Lyorodin, Dapotum, Mirenil, Trancin, Liogen, Motipress, Siqualone, Valamina, Pacinol, Lyogen, Fluphenazine hydrochloride, OMCA, Fluphenazine dihydrochloride

Molecular Formula:	C₂₂H₂₈Cl₂F₃N₃OS	Molecular Weight:	510.443430 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: MBHNWCYEGXQEIT-UHFFFAOYSA-N

• Gabapentin

IUPAC Name: 2-[1-(aminomethyl)cyclohexyl]acetic acid | CAS Registry Number: 60142-96-3
Synonyms: gabapentin, Neurontin, Gabapetin, Gabapentine, Aclonium, Gabapentin GR, Gabapen, Novo-Gabapentin, Apo-Gabapentin, Gabapentin Hexal, Gabapentin Stada, PMS-Gabapentin, Gabapentino [Spanish], Neurontin (TN), Prestwick_151, Gabapentin-ratiopharm, Gabapentine [INN-French], Gabapentinum [INN-Latin], Gabapentino [INN-Spanish], gabapentin (Neurontin)

Molecular Formula:	C₉H₁₇NO₂	Molecular Weight:	171.236780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: UGJMXCAKCUNAIE-UHFFFAOYSA-N

• Gemfibrozil

IUPAC Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid | CAS Registry Number: 25812-30-0
Synonyms: gemfibrozil, Lopid, Lipur, Decrelip, Trialmin, Bolutol, Lipazil, Litarek, Ausgem, Pilder, Jezil, Apo-Gemfibrozil, Gemfibromax, Gemfibrosil, Renabrazin, Cholespid, Fibratol, Fibrocit, Gemfibril, Gemlipid

Molecular Formula:	C₁₅H₂₂O₃	Molecular Weight:	250.333380 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: HEMJJKBWTPKOJG-UHFFFAOYSA-N

• Gestodene

IUPAC Name: (17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 60282-87-3
Synonyms: GESTODENE, Gestodenum [INN-Latin], Gestodeno [INN-Spanish], Gestodene [USAN:BAN:INN], HSDB 3594, CID43249, SH B 331, EINECS 262-145-8, BRN 4237181, 17-alpha-Ethinyl-13-ethyl-17-beta-hydroxy-4,15-gonadien-3-one, 13-Ethyl-17-hydroxy-18,19-dinor-17alpha-pregna-4,15-dien-20-yn-3-one, 18,19-Dinorpregna-4,15-dien-20-yn-3-one, 13-ethyl-17-hydroxy-, (17-alpha)-, Pregna-4,15-dien-20-yn-3-one, 13-ethyl-17-hydroxy-18,19-dinor-, (17alpha)-

Molecular Formula:	C₂₁H₂₆O₂	Molecular Weight:	310.429940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: SIGSPDASOTUPFS-KQMXEUTGSA-N

• Glucosamine Sulfate

IUPAC Name: (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanal; sulfuric acid | CAS Registry Number: 29031-19-4
Synonyms: Glucosamine sulfate, D-Glucosamine sulphate, EINECS 249-379-6, CID115046, 2-Amino-2-deoxy-D-glucose sulfate (salt), D-Glucose, 2-amino-2-deoxy-, sulfate (salt)

Molecular Formula:	C₆H₁₅NO₉S	Molecular Weight:	277.249600 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	10

InChIKey: FGNPLIQZJCYWLE-BTVCFUMJSA-N

• Glycyrrhizinic Acid

IUPAC Name: (2S,3S,4S,5R,6S)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-5-[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | CAS Registry Number: 1405-86-3
Synonyms: glycyrrhizin, Glycyrrhizic acid, Glycyrrhizinic acid, Glycyrrizin, Glycyron, Liquorice, Glycyrrhizinate, Glycyram, Zinc Glycyrrhizate, Glycyrrhizin [JAN], Glycyrrhizin (JAN), Glycyrrhetinic acid glycoside, Ambap5075, 18-beta-Glycyrrhizic acid, Dipotassium glycyrrhizinate, Rizinsan K2 A2 (free acid), HSDB 496, AMMONIUM GLYCYRRHIZINATE, NSC 2800, CHEBI:15939

Molecular Formula:	C₄₂H₆₂O₁₆	Molecular Weight:	822.932080 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	16

InChIKey: LPLVUJXQOOQHMX-QWBHMCJMSA-N

• Hyaluronic Acid

IUPAC Name: (2S,3S,4R,5R,6R)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-methoxyoxane-2-carboxylate | CAS Registry Number: 9004-61-9
Synonyms: hyaluronate, HYALURONIC ACID, [beta-N-acetyl-D-glucosaminyl(1->4)beta-D-glucuronosyl(1->3)](n)

Molecular Formula:	C₁₅H₂₄NO₁₂-	Molecular Weight:	410.350560 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	12

InChIKey: GXMRSXSVVLWYCI-XTLSIONJSA-M

• Hydroxocobalamin Hcl

IUPAC Name: cobalt(2+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(1R,2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-id-3-yl]propanoylamino]propan-2-yl] phosphate;hydrate;hydrochloride | CAS Registry Number: 58288-50-9
Synonyms: Vitamin B12a, OH-Cbl HCl, Aquocobalamin chloride, Hydroxocobalamin hydrochloride, Hydroxocobalamine hydrochloride, 78091-12-0, |A-(5,6-Dimethylbenzimidazolyl)hydroxocobamide hydrochloride

Molecular Formula:	C₆₂H₉₁ClCoN₁₃O₁₅P	Molecular Weight:	1383.823997 [g/mol]
H-Bond Donor:	11	H-Bond Acceptor:	20

InChIKey: BBQILPBAMXKFOB-BXSGNKEGSA-L

• Hydroxychloroquine Sulfate

IUPAC Name: 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol; sulfuric acid | CAS Registry Number: 747-36-4
Synonyms: Plaquenil, Ercoquin, Plaquinol, Toremonil, Plaquenil sulfate, Plaquenil (TN), HYDROXYCHLOROQUINE SULFATE, Hydroxychloroquine sulphate, SPECTRUM1503978, C18H26ClN3O.H2O4S, HYDROXYCHLOROQINE SULFATE, NSC 4375, EINECS 212-019-3, Hydroxychloroquine sulfate (USP), Hydroxychloroquine sulfate [USP], NSC4375, AI3-52706, NCGC00095090-01, NCGC00095090-02, CPD000525253

Molecular Formula:	C₁₈H₂₈ClN₃O₅S	Molecular Weight:	433.950020 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: JCBIVZZPXRZKTI-UHFFFAOYSA-N

• Hydroxyzine Hydrochloride

IUPAC Name: 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethanol dihydrochloride | CAS Registry Number: 2192-20-3
Synonyms: Atarax, Neurolax, Orgatrax, Paxistil, Vistaject, Vistarex, Vistaril, Vistazine, Arcanax, Atazina, Alamon, Aterax, Disron, Durrax, Quiess, Marax, hydroxyzine, Atranine A, Vistaril steraject, Hydroxyzine Hcl

Molecular Formula:	C₂₁H₂₉Cl₃N₂O₂	Molecular Weight:	447.826160 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: ANOMHKZSQFYSBR-UHFFFAOYSA-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

• Ivermectin

Synonyms: IVERMECTIN, 22,23-Dihyroavermectin B1, 22,23-Dihydroxy-avermectin B, DB00602, 5-O-demethyl-22,23-dihydro-avermectin A1a, C07970

Molecular Formula:	C₉₅H₁₄₆O₂₈	Molecular Weight:	1736.158940 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	28

InChIKey: SPBDXSGPUHCETR-MVGRHBATSA-N

• Ketoprofen

IUPAC Name: 2-[3-(benzoyl)phenyl]propanoic acid | CAS Registry Number: 22071-15-4
Synonyms: ketoprofen, Orudis, Ketoprophene, Ketoprofene, Alrheumun, Capisten, Profenid, Oruvail, Epatec, Aneol, Alrheumat, Alrheumum, Actron, racemic-Ketoprofen, Ketoprofen (+-), Orudis KT, m-Benzoylhydratropic acid, Orudis (TN), Prestwick_617, 3-Benzoylhydratropic acid

Molecular Formula:	C₁₆H₁₄O₃	Molecular Weight:	254.280560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: DKYWVDODHFEZIM-UHFFFAOYSA-N

• Ketotifen Fumarate

Synonyms: Zaditen, KETOTIFEN FUMARATE, Zaditor, Alaway, Prestwick_743, Zaditen (TN), Ketotifen fumarate salt, HC 20,511 fumarate, Ketotifen hydrogen fumarate, Ketotifen fumarate [USAN:JAN], MLS000069701, MLS000758236, MLS001148200, MLS001401421, K2628_SIGMA, SPECTRUM1500668, C19H21NOS.C4H4O4, EINECS 252-100-0, Ketotifen Fumarate (JP15/USAN), NCGC00094057-01

Molecular Formula:	C₂₃H₂₃NO₅S	Molecular Weight:	425.497420 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: YNQQEYBLVYAWNX-WLHGVMLRSA-N

• Kojic Acid Dipalmitate

IUPAC Name: (5-hexadecanoyloxy-4-oxopyran-2-yl)methyl hexadecanoate | CAS Registry Number: 79725-98-7
Synonyms: Kojic acid dipalmitate, (4-Oxo-5-(palmitoyloxy)-4H-pyran-2-yl)methyl palmitate, KSC923Q6F, CTK8C3862, ANW-70713, AKOS016007920, AK105268, M596, KB-208390, K0050, K-7050, 5-(Palmitoyloxy)-2-[(palmitoyloxy)methyl]-4H-pyran-4-one

Molecular Formula:	C₃₈H₆₆O₆	Molecular Weight:	618.927040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: SGEADTGIZKXPIP-UHFFFAOYSA-N

• Levofloxacin

Synonyms: LEVOFLOXACIN, Levaquin, Iquix, Elequine, Cravit, Quixin, L-Ofloxacin, R-Ofloxacin, Floxacin, Oftaquix, Tavanic, d-Levofloxacin, (S)-Ofloxacin, (-)-Ofloxacin, Ofloxacin S-(-)-form, (R)-isomer, S-(-)-Ofloxacin, (S)-(-)-Ofloxacin, Ambap1065, Spectrum_001719

Molecular Formula:	C₁₈H₂₀FN₃O₄	Molecular Weight:	361.367503 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: GSDSWSVVBLHKDQ-JTQLQIEISA-N

• Lycopene

IUPAC Name: (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene | CAS Registry Number: 502-65-8
Synonyms: LYCOPENE, Psi,psi-carotene, trans-Lycopene, prolycopene, all-trans-Lycopene, Lycopene 7, Lycopene (VAN), Natural yellow 27, Lycopene all-trans-, Ambap482, Lycopene, all-trans-, .psi.,.psi.-Carotene, CCRIS 7925, BSPBio_003389, L9879_SIGMA, Lycopene, all-trans- (8CI), CHEBI:15948, EINECS 207-949-1, NSC 407322, C40H56

Molecular Formula:	C₄₀H₅₆	Molecular Weight:	536.872640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: OAIJSZIZWZSQBC-GYZMGTAESA-N

• Mebendazole and Polymorph C

IUPAC Name: methyl N-[6-(benzoyl)-1H-benzimidazol-2-yl]carbamate | CAS Registry Number: 31431-39-7
Synonyms: mebendazole, Vermox, Telmin, Mebenvet, Vermirax, Mebenoazole, Ovitelmin, Pantelmin, Bantenol, Mebutar, Lomper, Vermicidin, Besantin, Verpanyl, Sufil, Noverme, Versid, Mebendazol, Madicure, MBDZ

Molecular Formula:	C₁₆H₁₃N₃O₃	Molecular Weight:	295.292720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: OPXLLQIJSORQAM-UHFFFAOYSA-N

• Megestrol

IUPAC Name: (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one | CAS Registry Number: 3562-63-8
Synonyms: megestrol, Megestrolo, Megestrolum, Megestrolo [DCIT], Megestryl acetate, Megestrolum [INN-Latin], Megestrol [INN:BAN], MEGESTROL ACETATE, UNII-EA6LD1M70M, HSDB 3233, EINECS 222-628-6, C24H32O4, CID19090, DB00351, LS-118488, 17-Hydroxy-6-methylpregna-4,6-diene-3,20-dione, C07120, Pregna-4,6-diene-3,20-dione, 17-hydroxy-6-methyl-, (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one, MGA

Molecular Formula:	C₂₂H₃₀O₃	Molecular Weight:	342.471800 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: VXIMPSPISRVBPZ-NWUMPJBXSA-N

• Nicarbazin

IUPAC Name: 1,3-bis(4-nitrophenyl)urea; 4,6-dimethyl-1H-pyrimidin-2-one | CAS Registry Number: 330-95-0
Synonyms: Nicarbazine, Nicrazine, Nicrazin, Nicoxin, Nirazin, Nicarb, Nicarbasin, Nicarbazin [BAN], MK 75, MK 75 (VAN), NSC 7171, EINECS 206-359-1, HSDB 7466, CID9507, NSC7171, AIDS167618, AIDS-167618, C13H10N4O5.C6H8N2O, AI3-60130, LS-51581

Molecular Formula:	C₁₉H₁₈N₆O₆	Molecular Weight:	426.382820 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: UKHWDRMMMYWSFL-UHFFFAOYSA-N

• Nimodipine

IUPAC Name: 5-O-(2-methoxyethyl) 3-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 66085-59-4
Synonyms: nimodipine, Nimotop, Periplum, Admon, Remontal, Brainal, Kenesil, Calnit, Modus, Nimodipin Hexal, NimodipinISIS, Nimodipin ISIS, Nimodipin-ISIS, Nimodipino Bayvit, Nimotop(TM), nchembio.79-comp6, Nimodipinum [INN-Latin], Nimodipino [INN-Spanish], Spectrum_001880, SpecPlus_000716

Molecular Formula:	C₂₁H₂₆N₂O₇	Molecular Weight:	418.440340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: UIAGMCDKSXEBJQ-UHFFFAOYSA-N

• Norepinephrine Tartrate

IUPAC Name: 4-(2-amino-1-hydroxyethyl)benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioate | CAS Registry Number: 3414-63-9
Synonyms: (+-)-Arterenol bitartrate, (+-)-Noradrenaline bitartrate, (+-)-Norepinephrine bitartrate, C8H11NO3.C4H6O6, EINECS 222-307-0, CID165118, LS-29921, Norepinephrine l-Tartrate (1:1), (+,-)-Isomer, (1)-beta,3,4-Trihydroxyphenethylammonium (R-(R*,R*))-hydrogen tartrate, Benzyl alcohol, alpha-(aminomethyl)-3,4-dihydroxy-, (+-)-, tartrate (1:1) (salt) (8CI), 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (+-)-, (R-(R*,R*))- 2,3-dihydroxybutanedioate (1:1) (salt), Benzyl alcohol, alpha-(aminomethyl)-3,4-dihydroxy-, (+-)-, tartrate (1:1) (salt), 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (+-)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1) (salt)

Molecular Formula:	C₁₂H₁₅NO₉-₂	Molecular Weight:	317.248800 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	10

InChIKey: WNPNNLQNNJQYFA-LREBCSMRSA-L

• Oxaliplatin

IUPAC Name: (1R,2R)-cyclohexane-1,2-diamine; oxalate; platinum(2+) | CAS Registry Number: 61825-94-3
Synonyms: oxaliplatin, oxalate, Oxalatoplatin, Oxalatoplatinum, Eloxatin, Eloxatin (TN), platinum(+2) cation, Oxaliplatinum [Latin], Oxaloplatine [French], Oxaliplatino [Spanish], Oxaloplatino [Spanish], Oxaliplatin (JAN/USAN/INN), Oxaliplatin [USAN:INN:BAN], (1R,2R)-cyclohexane-1,2-diamine, DB00526, D01790

Molecular Formula:	C₈H₁₄N₂O₄Pt	Molecular Weight:	397.285760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: ZROHGHOFXNOHSO-BNTLRKBRSA-L

• Phentolamine Mesylas

IUPAC Name: 3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol | CAS Registry Number: 50-60-2
Synonyms: phentolamine, Fentolamin, Regitine, Dibasin, Regitin, Regityn, phentolamine mesilate, Phentolamine mesylate, nchembio705-6, C 7337 Ciba, Spectrum_000077, Fentolamina [INN-Spanish], Phentolaminum [INN-Latin], Prestwick0_000230, Prestwick1_000230, Prestwick2_000230, Prestwick3_000230, Spectrum3_000788, Spectrum4_000899, Spectrum5_001704

Molecular Formula:	C₁₇H₁₉N₃O	Molecular Weight:	281.352260 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: MRBDMNSDAVCSSF-UHFFFAOYSA-N

• Piroctone Olamine

IUPAC Name: 2-aminoethanol; 1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)pyridin-2-one | CAS Registry Number: 68890-66-4
Synonyms: Octopirox, Octopirox (TN), PIROCTONE OLAMINE, Piroctone ethanolamine salt, Piroctone olamine [USAN], Piroctone olamine (USAN), C14H23NO2.C2H7NO, EINECS 272-574-2, LS-133057, D05505, 1-Hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)-2-(1H)pyridinone, 2-aminoethanol salt, 1-Hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)-2(1H)-pyridone compound with 2-aminoethanol (1:1), 1-Hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)pyridin-2(1H)-one, compound with 2-aminoethanol (1:1), 2(1H)-Pyridinone, 1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)-, compd. with 2-aminoethanol (1:1), 2(1H)-Pyridinone, 1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)-, compound with 2-aminoethanol (1:1)

Molecular Formula:	C₁₆H₃₀N₂O₃	Molecular Weight:	298.421000 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: BTSZTGGZJQFALU-UHFFFAOYSA-N

• Pregnenolone

IUPAC Name: 1-[(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone | CAS Registry Number: 145-13-1
Synonyms: pregnenolone, Arthenolone, Skinostelon, Pregnetan, Pregneton, Pregnolon, Regnosone, Prenolon, Enelone, Pregneninolone, Natolone, Bina-Skin, delta5-Pregnenolone, 5-Pregnenolone, Prestwick_859, 5-Pregnen-3beta-ol-20-one, 3beta-Hydroxypregn-5-en-20-one, Pregnenolonum [INN-Latin], Pregnenolona [INN-Spanish], Prestwick0_000546

Molecular Formula:	C₂₁H₃₂O₂	Molecular Weight:	316.477580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ORNBQBCIOKFOEO-QGVNFLHTSA-N

• Propranolol HCl

IUPAC Name: 1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol hydrochloride | CAS Registry Number: 318-98-9
Synonyms: Inderal, Avlocardyl, Dociton, InnoPran XL, Propranolol.HCl, Propranovitan, Anapriline, Dibudinate, Dumopranol, Hemipralon, Inderalici, Indermigran, Novopranol, Propayerst, Proprahexal, Anaprilin, Arcablock, Artensol, Berkolol, Blocaryl

Molecular Formula:	C₁₆H₂₂ClNO₂	Molecular Weight:	295.804380 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: ZMRUPTIKESYGQW-UHFFFAOYSA-N

• Propylthiouracil

IUPAC Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one | CAS Registry Number: 51-52-5
Synonyms: propylthiouracil, Prothiucil, Prothiurone, Prothycil, Prothyran, Protiural, Thiuragyl, Procasil, Propacil, Propycil, Propyl-Thiorist, Propyl-Thyracil, Propyl-Thiorit, Propylthiorit, Propythiouracil, 6-Propyl-2-thiouracil, Propilthiouracil, Thyreostat II, 6-Propylthiouracil, Tegretol

Molecular Formula:	C₇H₁₀N₂OS	Molecular Weight:	170.232100 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: KNAHARQHSZJURB-UHFFFAOYSA-N

• Pyrantel Pamoate

IUPAC Name: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid; 1-methyl-2-[(E)-2-thiophen-2-ylethenyl]-5,6-dihydro-4H-pyrimidine | CAS Registry Number: 22204-24-6
Synonyms: pyrantel pamoate, Antiminth, Combantrin, Embovin, Drontal, Pyrantel embonate, Drontal Plus, Mixture Name, Heartgard-30 Plus, Pamoate, Pyrantel, Antiminth (TN), Embonate, Pyrantel, Spectrum5_001373, Pyrantel pamoate [USAN:JAN], SPECTRUM1500517, Pyrantel pamoate (JP15/USP), EINECS 244-837-1, AIDS092504, NSC 355080, AIDS-092504

Molecular Formula:	C₃₄H₃₀N₂O₆S	Molecular Weight:	594.676800 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: AQXXZDYPVDOQEE-MXDQRGINSA-N

• Ramipril

IUPAC Name: (2S,3aS,6aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylic acid | CAS Registry Number: 87333-19-5
Synonyms: ramipril, Tritace, Altace, Carasel, Triatec, Ramace, Delix, Lostapres, Cardace, Pramace, Acovil, Hytren, Vesdil, Quark, Unipril, Ramiprilum [Latin], Altace (TN), Ramipril (USP/INN), Spectrum_001958, Hoe-498

Molecular Formula:	C₂₃H₃₂N₂O₅	Molecular Weight:	416.510580 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: HDACQVRGBOVJII-JBDAPHQKSA-N

• Rimantadine Hydrochloride

IUPAC Name: 1-(1-adamantyl)ethanamine hydrochloride | CAS Registry Number: 1501-84-4
Synonyms: Flumadine, Meradane, rimantadine, Rimantadine hydrochloride, Remantadine, Meradan, Oclovir, Roflual, Rimantadine HCL, Flumadine (TN), Remantadine hydrochloride, EXP 126, C12H21N.HCl, JP 61, 1-Adamantan-1-yl-ethylamine, MLS000069661, MLS000332981, Rimantadine hydrochloride [USAN], 390593_ALDRICH, EXP-126

Molecular Formula:	C₁₂H₂₂ClN	Molecular Weight:	215.762780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: OZBDFBJXRJWNAV-UHFFFAOYSA-N