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Ningbo Pangs Chem Int'l Co., Ltd.

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Profile: Ningbo Pangs Chem Int'l Co., Ltd. is a supplier of natural plant extracts, nutritional supplements and chemical materials. Our product line includes pharmaceutical chemicals such as 4-hydroxycoumarin, 5-fluorouracil, adenine, baclofen, biapenem, captopril, dimetridazole, glimepiride, nateglinide, niflumic acid, morniflumate, chitosan and metoprolol. We offer nutritional additives such as fructose, chondroitin sulfate, melatonin, calcium caseinate, calcium citrate, calcium gluconate, ferrous lactate and potassium sorbate.

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• 2,4,5-Trichloropyrimidine
IUPAC Name: 2,4,5-trichloropyrimidine | CAS Registry Number: 5750-76-5
Synonyms: Pyrimidine, 2,4,5-trichloro-, 652032_ALDRICH, NSC40593, AIDS124615, AIDS-124615, NSC 40593, ZINC01672144, NCI60_003837, TL8003699

Molecular Formula: C4HCl3N2Molecular Weight: 183.423140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GIKMWFAAEIACRF-UHFFFAOYSA-N

• 2-Amino-5-bromopyrimidine
IUPAC Name: 5-bromopyrimidin-2-amine | CAS Registry Number: 7752-82-1
Synonyms: 5-Bromo-2-pyrimidinamine, 2-Pyrimidinamine, 5-bromo-, 5-bromopyrimidin-2-ylamine, Pyrimidine, 2-amino-5-bromo-, 303526_ALDRICH, NSC27269, SBB000184, ZINC00967319, TL806169, AC-907/25014021, SR-01000639998-1

Molecular Formula: C4H4BrN3Molecular Weight: 173.998660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UHRHPPKWXSNZLR-UHFFFAOYSA-N

• 2,5-Dichlorothiophene-3-Sulfonamide
IUPAC Name: 2,5-dichlorothiophene-3-sulfonamide | CAS Registry Number: 53595-68-9
Synonyms: Maybridge1_001406, 542768_ALDRICH, 2,5-Dichloro-3-thiophenesulfonamide, 2,5-Dichlorothiophene-3-sulfonamide, BRN 1285314, 3-Thiophenesulfonamide, 2,5-dichloro-, SBB003266, ZINC01044581, CID2799888, LS-153171, TL8006898

Molecular Formula: C4H3Cl2NO2S2Molecular Weight: 232.108120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BUQKISCVZMIFEF-UHFFFAOYSA-N

• 2,5-Dibromobenzoic Acid
IUPAC Name: 2,5-dibromobenzoic acid | CAS Registry Number: 610-71-9
Synonyms: 2,5-Dibromobenzoic acid, BENZOIC ACID, 2,5-DIBROMO-, 516759_ALDRICH, EINECS 210-234-7, NSC190697, NSC 190697, CID11891, BRN 1868193, LS-36757, ST5408571, TL8003864, 4-09-00-01027 (Beilstein Handbook Reference)

Molecular Formula: C7H4Br2O2Molecular Weight: 279.913460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SQQKOTVDGCJJKI-UHFFFAOYSA-N

• 2,4,5-Trifluoro-3-Methoxybenzoic Acid
IUPAC Name: 2,4,5-trifluoro-3-methoxybenzoic acid | CAS Registry Number: 112811-65-1
Synonyms: 3-methoxy-2,4,5-trifluorobenzoic acid, 2,4,5-Trifluoro-3-methoxybenzoic acid, 11281-65-5, 2,4,5-Trifluoro-m-anisic Acid, SBB063543, PubChem1352, PubChem2237, 2,4,5-trifluoro-3-methoxy-benzoic Acid, ACMC-1BT5Z, AC1MC02Q, AC1Q45KE, KSC181I7H, 524824_ALDRICH, Jsp000992, Jsp000997, CTK0I1473, MolPort-000-157-015, ACT12274, ANW-16530, 3-Methoxy-2,4,5-trifluorobenzoicacid

Molecular Formula: C8H5F3O3Molecular Weight: 206.118710 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: YVJHZWWMKFQKDC-UHFFFAOYSA-N

• 2,5-Dihydroxybenzaldehyde
IUPAC Name: 2,5-dihydroxybenzaldehyde | CAS Registry Number: 1194-98-5
Synonyms: Gentisaldehyde, Gentisate aldehyde, Ambap5842, Benzaldehyde, 2,5-dihydroxy-, 2,5-DHBAOP, NCIOpen2_000629, D108200_ALDRICH, CHEBI:28508, 2,5-Dihydroxybenzaldehyde polymer, AIDS220859, AIDS220866, AIDS-220859, AIDS-220866, CID70949, NSC72387, EINECS 214-789-6, NSC 72387, ZINC00895809, C05585, InChI=1/C7H6O3/c8-4-5-3-6(9)1-2-7(5)10/h1-4,9-10

Molecular Formula: C7H6O3Molecular Weight: 138.120740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CLFRCXCBWIQVRN-UHFFFAOYSA-N

• (S)-3-Aminoquinuclidine hydrochloride
IUPAC Name: (3S)-1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride | CAS Registry Number: 119904-90-4
Synonyms: (S)-3-Aminoquinuclidine dihydrochloride, (S)-(-)-3-Aminoquinuclidine dihydrochloride, SureCN222751, KSC498E6T, 415723_ALDRICH, CTK3J8269, MolPort-001-769-431, MolPort-016-582-186, ACT02255, ANW-52491, OR6142, RW2223, (S)-(-)-3-Aminoquinuclidine 2HCl, (S)-3-AMINOQUINUCLIDINE 2HCL, AKOS015897102, AC-1559, AG-B-75156, (S)-Quinuclidin-3-amine dihydrochloride, AK-32971, BR-32971

Molecular Formula: C7H16Cl2N2Molecular Weight: 199.121340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: STZHBULOYDCZET-XCUBXKJBSA-N

• 5-(Bromomethyl)-alpha,alpha,alpha,alpha-tetramethyl-1,3-benzenediacetonitrile
IUPAC Name: 2-[3-(bromomethyl)-5-(2-cyanopropan-2-yl)phenyl]-2-methylpropanenitrile | CAS Registry Number: 120511-84-4
Synonyms: 3,5-bis(2-cyanoprop-2-yl)benzyl bromide, SBB054914, 2-[3-(bromomethyl)-5-(1-cyano-1-methylethyl)phenyl]-2-methylpropanenitrile, 5-bromomethyltetramethyl-1,3-benzenediacetonitrile, 2,2'-(5-(Bromomethyl)-1,3-phenylene)bis(2-methylpropanenitrile), 5-(Bromomethyl)-a,a,a ,a -tetramethyl-1,3-benzenediacetonitrile, zlchem 553, PubChem14362, AGN-PC-00ATFA, SureCN2258695, CTK7C5027, ZLC0418, MolPort-005-935-643, ANW-46630, ZINC21986320, AKOS015889686, AC-6804, AG-B-88288, 3,5-bis(2-cyanoprop-2-yl)benzylbromide, AK-56336

Molecular Formula: C15H17BrN2Molecular Weight: 305.212880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IHXHGCDOJLOZML-UHFFFAOYSA-N

• 3-Acetylthiophene
IUPAC Name: 1-thiophen-3-ylethanone | CAS Registry Number: 1468-83-3
Synonyms: 3-ACETYLTHIOPHENE, 1-thien-3-ylethanone, Ketone, methyl 3-thienyl, Ethanone, 1-(3-thienyl)-, Methyl 3-thienyl ketone, Methyl-3-thienyl ketone, 1-(3-Thienyl)ethanone, 196320_ALDRICH, BB_SC-4782, ALBB-005994, EINECS 215-996-4, ZINC00334460, TL8006177, AI-942/40192066

Molecular Formula: C6H6OSMolecular Weight: 126.176240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RNIDWJDZNNVFDY-UHFFFAOYSA-N

• 2,3-Pyridinediol
IUPAC Name: 3-hydroxy-1H-pyridin-2-one | CAS Registry Number: 16867-04-2
Synonyms: 2,3-DIHYDROXYPYRIDINE, Pyridine-2,3-diol, 2(1H)-Pyridinone, 3-hydroxy-, 3-Hydroxy-2-pyridone, 2(1H)-Pyridone, 3-hydroxy-, 3-Hydroxy-2(1H)-pyridinone, 2,3-DHBEEOP, 2,3-Pyridinediol (8CI), 3-hydroxypyridin-2(1H)-one, 122505_ALDRICH, NSC49272, EINECS 240-887-3, NSC 49272, ZINC00331622, AIDS081855, AIDS-081855, CID28115, SBB004333, AI3-61776, 13466-42-7 (DELETED)

Molecular Formula: C5H5NO2Molecular Weight: 111.098700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GGOZGYRTNQBSSA-UHFFFAOYSA-N

• 2-Mercapto-5-methylbenzimidazole
IUPAC Name: 5-methyl-1,3-dihydrobenzimidazole-2-thione | CAS Registry Number: 27231-36-3
Synonyms: 5-Methyl-2-mercaptobenzimidazole, 5-Methyl-2-benzimidazolethiol, 305243_ALDRICH, EINECS 248-350-5, AIDS022711, NSC 231400, AIDS-022711, NSC231400, SBB017015, ZINC00105202, LS-185778, 1,3-Dihydro-5-methyl-2H-benzimidazole-2-thione, 2H-Benzimidazole-2-thione, 1,3-dihydro-5-methyl-, InChI=1/C8H8N2S/c1-5-2-3-6-7(4-5)10-8(11)9-6/h2-4H,1H3,(H2,9,10,11, 2360-37-4

Molecular Formula: C8H8N2SMolecular Weight: 164.227520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: CWIYBOJLSWJGKV-UHFFFAOYSA-N

• (3-Dimethylaminopropyl)triphenylphosphonium Bromide Hydrobromide
IUPAC Name: 3-(dimethylamino)propyl-triphenylphosphanium;bromide;hydrobromide | CAS Registry Number: 27710-82-3
Synonyms: [3-(Dimethylamino)propyl]triphenylphosphonium bromide hydrobromide, (3-(dimethylamino)propyl)triphenylphosphonium bromide hydrobromide, (3-dimethylaminopropyl)triphenylphosphonium bromide hbr, KSC201S2P, CTK1A1927, MolPort-003-986-707, ANW-73138, AKOS015889870, AB02982, AC-4737, AM84872, AK106139, KB-70744, N760, TL8002222, FT-0638717, ST51051796, I01-3548, 3-dimethylaminopropyltriphenylphosphonium bromide hydrobromide, [3-(DIMETHYLAMINO)PROPYL]TRIPHENYLPHOSPHANIUM BROMIDE HYDROBROMIDE

Molecular Formula: C23H28Br2NPMolecular Weight: 509.256882 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NEQVFHFOWYYPBS-UHFFFAOYSA-M

• 2-Chloro-5-fluoropyridine
IUPAC Name: 2-chloro-5-fluoropyridine | CAS Registry Number: 31301-51-6
Synonyms: Ambap7054, 2-Chloro-5-Fluoro Pyridine, TPC-PY082, 643556_ALDRICH, ZINC02384133, CID2782801, TL8002387

Molecular Formula: C5H3ClFNMolecular Weight: 131.535423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QOGXQLSFJCIDNY-UHFFFAOYSA-N

• 2-Chloro-4-(trifluoromethyl)pyrimidine
IUPAC Name: 2-chloro-4-(trifluoromethyl)pyrimidine | CAS Registry Number: 33034-67-2
Synonyms: 4-(trifluoromethyl)-2-chloropyrimidine, 2-chloro-4-trifluoromethylpyrimidine, SBB054480, AG-F-10949, PYRIMIDINE, 2-CHLORO-4-(TRIFLUOROMETHYL)-, ZINC02159588, PubChem6907, AC1MCNNC, ACMC-209hxy, AC1Q4JG1, KSC222E4J, 407070_ALDRICH, CTK1C2244, MolPort-000-153-661, ABBYPHARMA AP-10-1130, ACT06639, ANW-27524, WT2150, 2-Chloro-4-trifluoromethyl-pyrimidine, AKOS001428771

Molecular Formula: C5H2ClF3N2Molecular Weight: 182.530990 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: FZRBTBCCMVNZBD-UHFFFAOYSA-N

• 2-Indanol
IUPAC Name: 2,3-dihydro-1H-inden-2-ol | CAS Registry Number: 4254-29-9
Synonyms: 2-Hydroxyindane, Indan-2-ol, Ambap4421, 1H-Inden-2-ol, 2,3-dihydro-, 180351_ALDRICH, NSC17485, EINECS 224-230-8, NSC 17485, ZINC01758758, 1H-Inden-2-ol, 2,3-dihydro- (9CI), InChI=1/C9H10O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4,9-10H,5-6H

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KMGCKSAIIHOKCX-UHFFFAOYSA-N

• 1-Butyl-2-methylindole
IUPAC Name: 1-butyl-2-methylindole | CAS Registry Number: 42951-35-9
Synonyms: 1-Butyl-2-methyl-1H-indole, 1H-Indole, 1-butyl-2-methyl-, CID3084883, B-9495

Molecular Formula: C13H17NMolecular Weight: 187.280780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: OPAHUBUOHKIOOL-UHFFFAOYSA-N

• 1-Octyl-2-methylindole
IUPAC Name: 2-methyl-1-octylindole | CAS Registry Number: 42951-39-3
Synonyms: 2-Methyl-N-octylindole, 2-Methyl-1-octyl-1H-indole, EINECS 256-016-5, 1H-Indole, 2-methyl-1-octyl-, CID170708, M-4280

Molecular Formula: C17H25NMolecular Weight: 243.387100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MOVCYDNEZZZSLV-UHFFFAOYSA-N

• 3-Methyl-3-pyrazolin-5-one
IUPAC Name: 5-methyl-1,2-dihydropyrazol-3-one | CAS Registry Number: 4344-87-0
Synonyms: 3-methyl-1H-pyrazol-5-ol, 5-PYRAZOLONE,3-METHYL, 303062_ALDRICH, ARONIS006692, 1H-pyrazol-5-ol, 3-methyl-, 3-Pyrazolin-5-one, 3-methyl-, NSC265335, STK012564, ZINC01471020, 3H-Pyrazol-3-one, 1,2-dihydro-5-methyl-, InChI=1/C4H6N2O/c1-3-2-4(7)6-5-3/h2H,1H3,(H2,5,6,7, 108-26-9

Molecular Formula: C4H6N2OMolecular Weight: 98.103240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WGVHNCAJPFIFCR-UHFFFAOYSA-N

• 2,3,5-tri-O-Benzyl-1-O-p-nitrobenzoyl-D-arabinofuranose
IUPAC Name: [3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl] 4-nitrobenzoate | CAS Registry Number: 52522-49-3
Synonyms: NSC98642, NSC231849, NSC232038, A1150/0053806, 2,3,5-Tri-O-benzyl-1-O-p-nitrobenzoyl-d-.beta.-arabinose, 81025-70-9

Molecular Formula: C33H31NO8Molecular Weight: 569.601140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: VBDBDZHLJKDSSB-UHFFFAOYSA-N

• 2-Acetyl-5-bromothiophene
IUPAC Name: 1-(5-bromothiophen-2-yl)ethanone | CAS Registry Number: 5370-25-2
Synonyms: 5-Bromo-2-acetylthiophene, 5-Bromo-2-thienyl methyl ketone, 329738_ALDRICH, NSC80366, 1-(5-Bromo-2-thienyl)ethanone, Ketone, 5-bromo-2-thienyl methyl, 2-ACETYL-5-BROMO-THIOPHENE, CID79335, EINECS 226-363-7, ZINC00096540, 1-(5-Bromo-2-thienyl)ethan-1-one, Ethanone, 1-(5-bromo-2-thienyl)-, ST5307038, SR-01000632181-1

Molecular Formula: C6H5BrOSMolecular Weight: 205.072300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: IGBZCOWXSCWSHO-UHFFFAOYSA-N

• 2,3-Dihydrobenzo[b]furan-5-carboxaldehyde
IUPAC Name: 2,3-dihydro-1-benzofuran-5-carbaldehyde | CAS Registry Number: 55745-70-5
Synonyms: 631957_ALDRICH, ZINC00154065, 2,3-Dihydrobenzofuran-5-carboxaldehyde, EINECS 259-788-1, CID735901, SBB005559, 2,3-dihyro-1-benzofuran-5-carbaldehyde, TL8006980

Molecular Formula: C9H8O2Molecular Weight: 148.158620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WEBVDBDZSOJGPB-UHFFFAOYSA-N

• 3-methyl-4-piperidone
IUPAC Name: 3-methylpiperidin-4-one | CAS Registry Number: 5773-58-0
Synonyms: 3-methylpiperidin-4-one, AG-G-03942, 3-Methyl-4-Piperidone Hydrochloride Monohydrate, PubChem15830, 3-methyl-4-piperidinone, 3-Methylpiperidine-4-one, 4-Piperidinone,3-methyl-, SureCN1019220, 4-Piperidinone, 3-methyl-, CTK5A7346, MolPort-003-986-973, ANW-53125, AKOS004122967, QC-3584, RP19104, AK-35717, KB-32768, TL8003709, AM20080736, FT-0649352

Molecular Formula: C6H11NOMolecular Weight: 113.157640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: KTWRIXHINMYODR-UHFFFAOYSA-N

• 3-Pipecoline
IUPAC Name: 3-methylpiperidine | CAS Registry Number: 626-56-2
Synonyms: 3-Methylpiperidine, beta-Pipecoline, Piperidine, 3-methyl-, .beta.-Pipecoline, beta-Methylpiperidine, .beta.-Methylpiperidine, 3-Pipecoline (8CI), M73001_ALDRICH, 68850_FLUKA, NSC66494, EINECS 210-953-6, NSC 66494, TL8004226, 53152-98-0

Molecular Formula: C6H13NMolecular Weight: 99.174120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JEGMWWXJUXDNJN-UHFFFAOYSA-N

• 1-(3-Methoxyphenyl)piperazine
IUPAC Name: 1-(3-methoxyphenyl)piperazine | CAS Registry Number: 16015-71-7
Synonyms: Maybridge4_000045, Oprea1_702483, N-(3-Methoxyphenyl)piperazine, 471682_ALDRICH, ALBB-005957, CID81430, NSC66266, EINECS 240-154-8, PDSP1_000006, PDSP2_000006, SBB003619, SDCCGMLS-0065814.P001, IDI1_030627

Molecular Formula: C11H16N2OMolecular Weight: 192.257540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PZIBVWUXWNYTNL-UHFFFAOYSA-N

• 2,2-Bis(hydroxymethyl)butyric acid
IUPAC Name: 2,2-bis(hydroxymethyl)butanoic acid | CAS Registry Number: 10097-02-6
Synonyms: 2,2-bis(hydroxymethyl)butanoic acid, 2,2-Dimethylolbutyric Acid, Butanoic acid, 2,2-bis(hydroxymethyl)-, SBB065923, AG-D-07037, AC1MNBKP, Dimethylol butanoic acid, LS-181605, ACMC-2097tk, KSC268K4R, Dimethylolbutanoic Acid(DMBA), 470627_ALDRICH, Jsp000175, CTK1G8548, JVYDLYGCSIHCMR-UHFFFAOYSA-, MolPort-001-770-814, ANW-14406, AKOS006220771, AM90355, RL00065

Molecular Formula: C6H12O4Molecular Weight: 148.157080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: JVYDLYGCSIHCMR-UHFFFAOYSA-N

• 2,4-Dichloro-1-nitrobenzene
IUPAC Name: 2,4-dichloro-1-nitrobenzene | CAS Registry Number: 611-06-3
Synonyms: 2,4-DICHLORONITROBENZENE, 1,3-Dichloro-4-nitrobenzene, Benzene, 2,4-dichloro-1-nitro-, CCRIS 3095, D68401_ALDRICH, ghl.PD_Mitscher_leg0.937, asym.-Nitro-m-dichlorobenzene, HSDB 4267, 36030_FLUKA, EINECS 210-248-3, NSC 43196, NSC43196, BRN 1451655, ZINC01675935, LS-1460, NCGC00091267-01, TL80074006, 4-05-00-00726 (Beilstein Handbook Reference), InChI=1/C6H3Cl2NO2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3

Molecular Formula: C6H3Cl2NO2Molecular Weight: 191.999520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QUIMTLZDMCNYGY-UHFFFAOYSA-N

• (S)-(-)-6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride
IUPAC Name: 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;hydrochloride | CAS Registry Number: 82586-62-7
Synonyms: 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride, 1,2,3,4-Tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid hydrochloride, 6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid hydrochloride, 30740-95-5, 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochoride, PubChem18220, SureCN7221546, CTK3E8039, (S)-6,7-Dimethoxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrochloride, MolPort-002-054-157, AA253, ACN-S002400, AKOS015846107, AB26768, AG-C-07376, AG-F-01706, AC-16712, KB-44498, KB-73770, KB-247411

Molecular Formula: C12H16ClNO4Molecular Weight: 273.712740 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: ROWPWZMWICGKBY-UHFFFAOYSA-N

• 4-Hydroxy isoleucine
IUPAC Name: (2S,3R)-2-amino-4-hydroxy-3-methylpentanoic acid | CAS Registry Number: 781658-23-9
Synonyms: L-4-Hydroxyisoleucine, (2S,3R)-2-amino-4-hydroxy-3-methylpentanoic acid, 4-Hydroxyisoleucine, 4-HYDROXY-L-ISOLEUCINE, AC1MCN81, CTK1G9350, MolPort-008-155-393, ANW-63423, AKOS005255263, AKOS015855988, AC-6053, AG-F-93633, AG-G-14466, AK-81079, AB3000024, KB-192741, FT-0647952, FT-0669694, FT-0686652, FT-0688335

Molecular Formula: C6H13NO3Molecular Weight: 147.172320 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: OSCCDBFHNMXNME-DSDZBIDZSA-N

• (e)-3-[3-(4-Fluorophenyl)-1-Isopropyl-1h-Indol-2-Yl]-Propenal
IUPAC Name: (E)-3-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]prop-2-enal | CAS Registry Number: 93957-50-7
Synonyms: Fenal, 1-Isopropyl-2-acrolein-3-(4-fluorophenyl)-indole, (e)-3-[3'-(4''-fluorophenyl)-1'-(1''-methylethyl)-1h-indol-2''-yl]-2-propnal, (E)-3-[3-(4-Fluorophenyl)-1-isopropyl-1H-indol-2-yl]-propenal, (E)-3-(3-(4-Fluorophenyl)-1-isopropyl-1H-indol-2-yl)acrylaldehyde, 3-(3-4-fluorophenyl-1-isopropyl-1h-indole-2-yl) propenal, (E)-3-[3-(4-Fluorophenyl)-1-isopropylindol-2-yl]acrolein, (E)-3-[3-(4-Fluorophenyl)-1-isopropylindol-2-yl]propenal, (e)-3-[3-(4-fluoro-phenyl)-1-isopropyl-1h-indol-2-yl]-propenal, (e)-3-[3-(4-fluorophenyl)-1-(isopropyl)-1h-indol-2-yl]-2-propenal, (2E)-3-[3-(4-Fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-2-propenal, (e)-3-[3'-(4''-fluorophenyl)-1'-(1''-methylethyl)indol-2'-yl]pro-2-penal, 3-(3-(4-FLUOROPHENYL)-1-ISOPROPYL-1H-INDOL-2-YL)ACRYLALDEHYDE, (e)-3-[3'-(4''-fluorophenyl)-1'-(1''-methylethyl)-1h-indol-2''-yl]-2-propenal, (e)-3-[3'-(4''-fluorophenyl)-1'-(1-methylethyl)-1h-indole-2yl] prop-2-enal, 129332-30-5, PubChem15645, MolPort-005-933-200, SBB066264, ZINC02513950

Molecular Formula: C20H18FNOMolecular Weight: 307.361423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DVWHSTKQJBIYCK-VMPITWQZSA-N

• 4-Pentylphenylacetylene
IUPAC Name: 1-ethynyl-4-pentylbenzene | CAS Registry Number: 79887-10-8
Synonyms: 1-Ethynyl-4-pentylbenzene, 1-ethynyl-4-pentyl-benzene, 4-n-Pentylphenylacetylene, 4-(Pent-1-yl)phenylacetylene, 4-Amylphenylacetylene, ACMC-209pid, AC1MCQ05, P-ETHYNYLPENTYLBENZENE, KSC491I8P, 457477_ALDRICH, CTK3J1487, MolPort-001-761-974, 1-Ethynyl-4-(pent-1-yl)benzene, ANW-37331, SBB088694, AKOS005146091, AG-H-20192, OR21955, RP17425, AK-48503

Molecular Formula: C13H16Molecular Weight: 172.266140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: APGNXGIUUTWIRE-UHFFFAOYSA-N

• 1-Piperidinethiocarboxamide
IUPAC Name: piperidine-1-carbothioamide | CAS Registry Number: 14294-09-8
Synonyms: 1-Piperidinecarbothioamide, piperidine-1-carbothioamide, NSC108222, STK398337, ZINC05413495, CID1551232, T0515-2939

Molecular Formula: C6H12N2SMolecular Weight: 144.237880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: UERQMZVFUXRQOD-UHFFFAOYSA-N

• (+)-Bis[(R)-1-Phenylethyl]amine Hydrochloride
IUPAC Name: bis[(1R)-1-phenylethyl]azanium | CAS Registry Number: 82398-30-9
Synonyms: ZINC01729680, ZINC01729683, CID6994959, I05-0295

Molecular Formula: C16H20N+Molecular Weight: 226.336700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: NXLACVVNHYIYJN-ZIAGYGMSSA-O

• (2s-(2a,6b(r*)))-Alpha-((hexahydro-5-Oxo-2-(2-Thienyl)-1,4-Thiazepin-6-Yl)amino)-Benzenebutanoic Acid Ethyl Ester
IUPAC Name: ethyl (2S)-2-[[(2S,6R)-5-oxo-2-thiophen-2-yl-1,4-thiazepan-6-yl]amino]-4-phenylbutanoate | CAS Registry Number: 110143-57-2
Synonyms: (2S,6R)-6-[[1(s)-ethoxycarbonyl-3-phenylpropyl]amino]-5-oxo-(2-thienyl)perhydro-1,4-thiazepine, (S)-Ethyl 2-(((2S,6R)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-6-yl)amino)-4-phenylbutanoate, CTK4A6795, MolPort-003-987-514, Benzenebutanoic acid, a-[[hexahydro-5-oxo-2-(2-thienyl)-1,4-thiazepin-6-yl]amino]-,ethyl ester, [2S-[2a,6b(R*)]]- (9CI), ANW-64034, SC3921, AKOS015902268, AG-D-27387, AK-55310, KB-62738, TL8006121, I14-13780, 1,4-Thiazepine,benzenebutanoic acid deriv.;(2S,6R)-6-[[1(s)-Ethoxycarbonyl-3-phenylpropyl]amino]-5-oxo-(2-thienyl)perhydro-1,4-thiazepine;

Molecular Formula: C21H26N2O3S2Molecular Weight: 418.572740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: MNASKBKMMDZKHG-LNLFQRSKSA-N

• 1,1-Cyclohexanediacetic Acid Monoamide
IUPAC Name: 2-[1-(2-amino-2-oxoethyl)cyclohexyl]acetate | CAS Registry Number: 99189-60-3
Synonyms: ZINC00366885, CID6948967

Molecular Formula: C10H16NO3-Molecular Weight: 198.238940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QJGSJXLCJRXTRY-UHFFFAOYSA-M

• 1,3,5-Trichlorobenzene (TCB)
IUPAC Name: 1,3,5-trichlorobenzene | CAS Registry Number: 108-70-3
Synonyms: s-Trichlorobenzene, sym-Trichlorobenzene, 1,3,5-TRICHLOROBENZENE, Benzene, 1,3,5-trichloro-, 1,3,5-Trichlorbenzol, CCRIS 5946, HSDB 132, 1,3,5-TRICHLORO-BENZENE, T54607_ALDRICH, 36555_RIEDEL, 442235_SUPELCO, NSC 4389, CHEBI:49916, EINECS 203-608-6, NSC4389, LS-468, AI3-22031, DB03836, NCGC00091181-01, TL806428

Molecular Formula: C6H3Cl3Molecular Weight: 181.447020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: XKEFYDZQGKAQCN-UHFFFAOYSA-N

• 2-(2-Thienyl)Ethanol
IUPAC Name: 2-thiophen-2-ylethanol | CAS Registry Number: 5402-55-1
Synonyms: 2-Thiopheneethanol, 2-(2-Thienyl)ethanol, Thiophen-2-ethanol, 2-(2-Hydroxyethyl)thiophene, 2-(2-Thienyl)-ethanol, 2-thiophen-2-yl-ethanol, Ethanol, 2-(2-thienyl)-, T27855_ALDRICH, NSC5136, 95488_FLUKA, CID79400, NSC 5136, EINECS 226-452-0, ZINC00391955, FS011370, ST5437475, TL8003542

Molecular Formula: C6H8OSMolecular Weight: 128.192120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VMJOFTHFJMLIKL-UHFFFAOYSA-N

• 2,3,4-Trihydroxybenzophenone
IUPAC Name: phenyl-(2,3,4-trihydroxyphenyl)methanone | CAS Registry Number: 1143-72-2
Synonyms: Gallobenzophenone, Alizarin yellow A, Alizarine Yellow A, Ambap7429, Oprea1_565948, 2,3,4-Trihydroxbenzophenone, 260576_ALDRICH, Benzophenone, 2,3,4-trihydroxy-, CID70837, NSC30665, EINECS 214-540-1, NSC 30665, ZINC00225866, Methanone, phenyl(2,3,4-trihydroxyphenyl)-, C.I. 57005, NCGC00164115-01, Phenyl(2,3,4-trihydroxyphenyl)-methanone, Benzophenone, 2,3,4-trihydroxy- (8CI), EU-0033390, InChI=1/C13H10O4/c14-10-7-6-9(12(16)13(10)17)11(15)8-4-2-1-3-5-8/h1-7,14,16-17

Molecular Formula: C13H10O4Molecular Weight: 230.216100 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: HTQNYBBTZSBWKL-UHFFFAOYSA-N

• 2,6-Diaminopyridine
IUPAC Name: pyridine-2,6-diamine | CAS Registry Number: 141-86-6
Synonyms: 2,6-pyridinediamine, pyridine, 2,6-diamino-, pyridine-2,6-diamine, DAP (amine), pyridine-2,6-diyldiamine, WLN: T6NJ BZ FZ, CCRIS 6682, D24404_ALDRICH, NSC 1921, 33321_FLUKA, EINECS 205-507-2, CID8861, NSC1921, BRN 0108513, SBB004340, AI3-18054, D253, TL806197, LS-131134, 5-22-11-00255 (Beilstein Handbook Reference)

Molecular Formula: C5H7N3Molecular Weight: 109.129180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VHNQIURBCCNWDN-UHFFFAOYSA-N

• 2,6-Dichlorobenzaldehyde
IUPAC Name: 2,6-dichlorobenzaldehyde | CAS Registry Number: 83-38-5
Synonyms: 2,6-DICHLOROBENZALDEHYDE, Benzaldehyde, 2,6-dichloro-, CCRIS 6014, D56500_ALDRICH, NSC7193, NSC 7193, 35260_FLUKA, EINECS 201-472-2, CID6737, ZINC00148002, LS-1824, NCGC00091746-01, NCGC00091746-02, TL806122, ST5199694, InChI=1/C7H4Cl2O/c8-6-2-1-3-7(9)5(6)4-10/h1-4

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DMIYKWPEFRFTPY-UHFFFAOYSA-N

• 2-Acetothiophene
IUPAC Name: 1-thiophen-2-ylethanone | CAS Registry Number: 88-15-3
Synonyms: 2-Acetothienone, 2-ACETYLTHIOPHENE, Ketone, methyl 2-thienyl, Methyl 2-thienyl ketone, alpha-Acetylthiophene, Ethanone, 1-(2-thienyl)-, 2-Thienyl methyl ketone, 1-(2-Thienyl)ethanone, Methyl-2-thienyl ketone, 1-thiophen-2-yl-ethanone, THIOPHENE,2-ACETYL, WLN: T5SJ BV1, A22602_ALDRICH, W503509_ALDRICH, NSC 2345, 01490_FLUKA, EINECS 201-804-6, NSC2345, AIDS018339, AIDS-018339

Molecular Formula: C6H6OSMolecular Weight: 126.176240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WYJOVVXUZNRJQY-UHFFFAOYSA-N

• 2-Benzyl Pyridine
IUPAC Name: 2-(phenylmethyl)pyridine | CAS Registry Number: 101-82-6
Synonyms: 2-BENZYLPYRIDINE, Pyridine, 2-benzyl-, Pyridine, 2-(phenylmethyl)-, 2-(Phenylmethyl)pyridine, B30200_ALDRICH, NSC 4033, EINECS 202-979-1, NSC4033, BRN 0115875, ZINC00967345, AI3-11559, LS-130284, ST5214501, TL8000102, 5-20-07-00556 (Beilstein Handbook Reference), AC-907/25014395, InChI=1/C12H11N/c1-2-6-11(7-3-1)10-12-8-4-5-9-13-12/h1-9H,10H

Molecular Formula: C12H11NMolecular Weight: 169.222440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PCFUWBOSXMKGIP-UHFFFAOYSA-N

• 2-Bromopyridine
IUPAC Name: 2-bromopyridine | CAS Registry Number: 109-04-6
Synonyms: 2-BROMOPYRIDINE, o-Bromopyridine, Pyridine, 2-bromo-, 2-Pyridyl bromide, beta-Bromopyridine, alpha-Bromopyridine, .alpha.-Bromopyridine, .beta.-Bromopyridine, PYRIDINE,2-BROMO, WLN: T6NJ BE, B80100_ALDRICH, NSC 8031, CHEBI:51574, EINECS 203-641-6, NSC8031, AIDS020378, AIDS-020378, BRN 0105789, SBB003999, ZINC00158586

Molecular Formula: C5H4BrNMolecular Weight: 157.995960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: IMRWILPUOVGIMU-UHFFFAOYSA-N

• 3,5-Diiodosalicylic Acid
IUPAC Name: 2-hydroxy-3,5-diiodobenzoic acid | CAS Registry Number: 133-91-5
Synonyms: 3,5-Diiodosalicylate, 2-Hydroxy-3,5-diiodobenzoic acid, Salicylic acid, 3,5-diiodo-, 3,5-DIIODOSALICYLIC ACID, DIIODOSALICYLIC ACID, 3,5-Diiodo-2-hydroxybenzoic acid, 2-Hydroxy-3,5-diiodobenzoate, Benzoic acid, 2-hydroxy-3,5-diiodo-, WLN: QVR BQ CI EI, D124001_ALDRICH, NSC6303, NSC 6303, EINECS 205-124-0, CID8631, AIDS018052, AIDS-018052, Benzoic acid, 3,5-diiodo-2-hydroxy-, 2-Hydroxy-3,5-diiodobenzenecarboxylic acid, BRN 2615358, STK301498

Molecular Formula: C7H4I2O3Molecular Weight: 389.913800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DHZVWQPHNWDCFS-UHFFFAOYSA-N

• 3-Bromophthalide
IUPAC Name: 3-bromo-3H-2-benzofuran-1-one | CAS Registry Number: 6940-49-4
Synonyms: 2-Bromophthalide, Phthalidyl bromide, 1(3H)-Isobenzofuranone, 3-bromo-, NSC60137, EINECS 230-084-6, NSC 60137, ST5410889, 75289-01-9

Molecular Formula: C8H5BrO2Molecular Weight: 213.028100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CLMSHAWYULIVFQ-UHFFFAOYSA-N

• 3-Chloro Phenyl Acetonitrile
IUPAC Name: 2-(3-chlorophenyl)acetonitrile | CAS Registry Number: 1529-41-5
Synonyms: m-Chlorobenzyl cyanide, 3-Chlorobenzyl cyanide, 3-Chlorophenylacetonitrile, 3-Chlorobenzeneacetonitrile, Acetonitrile, (m-chlorophenyl)-, (m-Chlorophenyl)acetonitrile, (3-Chlorophenyl)acetonitrile, C27808_ALDRICH, BENZENEACETONITRILE, 3-CHLORO-, EINECS 216-213-9, BRN 2042965, ZINC00155172, Benzeneacetonitrile, 3-chloro- (9CI), LS-13226, 4-09-00-01675 (Beilstein Handbook Reference), T5297923

Molecular Formula: C8H6ClNMolecular Weight: 151.592940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GTIKLPYCSAMPNG-UHFFFAOYSA-N

• 19-Norandrost-5(10)-Ene-Dione
IUPAC Name: (8R,9S,13S,14S)-13-methyl-1,2,4,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 3962-66-1
Synonyms: Oestr-5(10)-ene-3,17-dione, EINECS 223-564-1, LS-64836

Molecular Formula: C18H24O2Molecular Weight: 272.381960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RORYLAUXKSWMQL-CBZIJGRNSA-N

• 1-Diphenyl Methyl Piperazine
IUPAC Name: 1-[di(phenyl)methyl]piperazine | CAS Registry Number: 841-77-0
Synonyms: Norcyclizine, 1-Benzhydrylpiperazine, Normethylcyclizine, Benzhydrylpiperazine, N-Benzhydrylpiperazine, 4-Benzhydrylpiperazine, Diphenylmethylpiperazine, 1-(Diphenylmethyl)piperazine, N-(Diphenylmethyl)piperazine, 1-Benzhydryl-piperazine, ChemDiv3_014411, Piperazine, 1-(diphenylmethyl)-, Oprea1_339020, CBDivE_013583, CBDivE_013587, MLS001202210, 43124_FLUKA, EINECS 212-667-7, PPP-0-0, NSC 35536

Molecular Formula: C17H20N2Molecular Weight: 252.354100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NWVNXDKZIQLBNM-UHFFFAOYSA-N

• 2,3,4,5-Tetrafluoro Benzoic Acid
IUPAC Name: 2,3,4,5-tetrafluorobenzoic acid | CAS Registry Number: 1201-31-6
Synonyms: 2,3,4,5-Tetrafluorobenzoic acid, 326267_ALDRICH, JRD-0761, NSC168728, ST5307040

Molecular Formula: C7H2F4O2Molecular Weight: 194.083193 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: SFKRXQKJTIYUAG-UHFFFAOYSA-N

• 2,4,5-Trimethoxy Benzoic Acid
IUPAC Name: 2,4,5-trimethoxybenzoic acid | CAS Registry Number: 490-64-2
Synonyms: Asaronic acid, 2,4,5-Trimethoxybenzoic acid, 138894_ALDRICH, Benzoic acid, 2,4,5-trimethoxy-, EINECS 207-715-9, 2,4,5,-TRIMETHOXYBENZOIC ACID, AI3-38428, ST5213896, TL8003281, InChI=1/C10H12O5/c1-13-7-5-9(15-3)8(14-2)4-6(7)10(11)12/h4-5H,1-3H3,(H,11,12

Molecular Formula: C10H12O5Molecular Weight: 212.199280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: KVZUCOGWKYOPID-UHFFFAOYSA-N

• 2,4,6-Triaminopyrimidine
IUPAC Name: pyrimidine-2,4,6-triamine | CAS Registry Number: 1004-38-2
Synonyms: Ambap161, 2,4,6-PYRIMIDINETRIAMINE, pyrimidine-2,4,6-triamine, Pyrimidine, 2,4,6-triamino-, T45802_ALDRICH, Pyrimidine-2,4,6-triyltriamine, AIDS023039, AIDS-023039, NSC26493, EINECS 213-720-7, NSC 26493, ZINC01511101, Pyrimidine, 2,4,6-triamino- (8CI), AI3-60016, TL8000051, TAP, InChI=1/C4H7N5/c5-2-1-3(6)9-4(7)8-2/h1H,(H6,5,6,7,8,9, 3AY, 42911-01-3, 42911-03-5

Molecular Formula: C4H7N5Molecular Weight: 125.131880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: JTTIOYHBNXDJOD-UHFFFAOYSA-N


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