Chemical Biology Tools
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5-AminobenzothiazoleCas#: 1123-93-9 Compound CID: 70749Formula: C7H6N2S Molecular Weight: 150.2IUPAC Name: 1,3-benzothiazol-5-amineSMILES: C1=CC2=C(C=C1N)N=CS2InChIKey: UJZYHMZRXGNDFB-UHFFFAOYSA-NInChI: InChI=1S/C7H6N2S/c8-5-1-2-7-6(3-5)9-4-10-7/h1-4H,8H2Synonyms: 2,4(1H,3H)-Pyrimidinedione, 5-methyl- | A802566 | BP-11254 | benzo[d]thiazol-5-amine;1,3-Benzothiazol-5-amine | 2-(4-...
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UCN-01, Inhibitor of 3-phosphoinositide dependent protein kinase 1;Inhibitor of checkpoint kinase 1;Inhibitor of checkpoint kinase 2;Inhibitor of cyclin dependent kinase 1;Inhibitor of glycogen synthase kinase 3 beta;Inhibitor of LCK proto-oncogene; Src family tyCas#: 112953-11-4 Compound CID: 72271Formula: C28H26N4O4 Molecular Weight: 482.53IUPAC Name: (2S,3R,4R,6R,18R)-18-hydroxy-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-oneSMILES: CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)C(NC6=O)O)NC)OCInChIKey: PBCZSGKMGDDXIJ-HQCWYSJUSA-NInChI: InChI=1S/C28H26N4O4/c1-28-25(35-3)15(29-2)12-18(36-28)31-16-10-6-4-8-13(16)19-21-22(27(34)30-26(21)33)20-14-9-5-7-11-17(14)32(28)24(20)23(19)31/h4-11,15,18,25,27,29,34H,12H2,1-3H3,(H,30,33)/t15-,18-,25-,27-,28+/m1/s1Synonyms: BDBM17054 | NSC638850 | NSC-638850 | 7-Hydroxystaurosporine [WHO-DD] | KRX0601 | KRX-0601 | Dietilamina | Isocyanic a...
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5-Chloro-2-propoxyphenylboronic acidCas#: 849062-29-9 Compound CID: 16217680Formula: C9H12BClO3 Molecular Weight: 214.45IUPAC Name: (5-chloro-2-propoxyphenyl)boronic acidSMILES: B(C1=C(C=CC(=C1)Cl)OCCC)(O)OInChIKey: FZDSWPMDXOYUBB-UHFFFAOYSA-NInChI: InChI=1S/C9H12BClO3/c1-2-5-14-9-4-3-7(11)6-8(9)10(12)13/h3-4,6,12-13H,2,5H2,1H3Synonyms: (5-Chloro-2-propoxyphenyl)boronic acid|849062-29-9|5-Chloro-2-propoxyphenylboronic acid|MFCD06411348|(5-Chloro-2-prop...
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5-Bromo-2-chloro-3-methoxypyridineCas#: 286947-03-3 Compound CID: 16748108Formula: C6H5BrClNO Molecular Weight: 222.47IUPAC Name: 5-bromo-2-chloro-3-methoxypyridineSMILES: COC1=C(N=CC(=C1)Br)ClInChIKey: GFJMOZYIDADKLJ-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrClNO/c1-10-5-2-4(7)3-9-6(5)8/h2-3H,1H3Synonyms: 5-bromo-2-chloro-3-methoxypyridine|286947-03-3|Pyridine, 5-bromo-2-chloro-3-methoxy-|MFCD08234976|Chloroaceticacidsod...
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Methyl 7-azaindole-3-carboxylateCas#: 808137-94-2 Compound CID: 21110084Formula: C9H8N2O2 Molecular Weight: 176.17IUPAC Name: methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylateSMILES: COC(=O)C1=CNC2=C1C=CC=N2InChIKey: XYRUNIAHPKBUJT-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O2/c1-13-9(12)7-5-11-8-6(7)3-2-4-10-8/h2-5H,1H3,(H,10,11)Synonyms: CG-0232 | BBL031597 | EN300-69170 | NSC783332 | PB14761 | 1H-Pyrrolo[2,3-b]Pyridine-3-Carboxylic Acid, Methyl Ester |...
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5-BromobenzofurazaneCas#: 51376-06-8 Compound CID: 2776298Formula: C6H3BrN2O Molecular Weight: 199.01IUPAC Name: 5-bromo-2,1,3-benzoxadiazoleSMILES: C1=CC2=NON=C2C=C1BrInChIKey: ZWDFFESFCIACQC-UHFFFAOYSA-NInChI: InChI=1S/C6H3BrN2O/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3HSynonyms: 5-bromo-2,1,3-benzoxadiazole | 5-Bromo-benzo[1,2,5]oxadiazole | AS-2018 | MFCD02682026 | AM20040599 | FT-0620066 | J-...
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5-Chlorovanillic acidCas#: 62936-23-6 Compound CID: 44215Formula: C8H7ClO4 Molecular Weight: 202.6IUPAC Name: 3-chloro-4-hydroxy-5-methoxybenzoic acidSMILES: COC1=C(C(=CC(=C1)C(=O)O)Cl)OInChIKey: XBRYEHVBBMSSCG-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClO4/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,10H,1H3,(H,11,12)Synonyms: 62936-23-6|3-CHLORO-4-HYDROXY-5-METHOXYBENZOIC ACID|5-CHLOROVANILLIC ACID|Benzoic acid, 3-chloro-4-hydroxy-5-methoxy-...
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5-Methoxy-2-thiouracilCas#: 6939-11-3 Compound CID: 2763759Formula: C5H6N2O2S Molecular Weight: 158.18IUPAC Name: 5-methoxy-2-sulfanylidene-1H-pyrimidin-4-oneSMILES: COC1=CNC(=S)NC1=OInChIKey: CDFYFTSELDPCJA-UHFFFAOYSA-NInChI: InChI=1S/C5H6N2O2S/c1-9-3-2-6-5(10)7-4(3)8/h2H,1H3,(H2,6,7,8,10)Synonyms: A900740 | 2-Mercapto-5-methoxypyrimidin-4-ol | AKOS005070237 | CS-W017959 | EN300-85914 | 5-Methoxy-2-thioxo-2,3-dihy...
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5-[4'-(Bromomethyl)-1,1'-biphenyl-2-yl]-1-triphenylmethyl-1H-tetrazoleCas#: 124750-51-2 Compound CID: 10053461Formula: C33H25BrN4 Molecular Weight: 557.5IUPAC Name: 5-[2-[4-(bromomethyl)phenyl]phenyl]-1-trityltetrazoleSMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C(=NN=N4)C5=CC=CC=C5C6=CC=C(C=C6)CBrInChIKey: ZTFVTXDWDFIQEU-UHFFFAOYSA-NInChI: InChI=1S/C33H25BrN4/c34-24-25-20-22-26(23-21-25)30-18-10-11-19-31(30)32-35-36-37-38(32)33(27-12-4-1-5-13-27,28-14-6-2-7-15-28)29-16-8-3-9-17-29/h1-23H,24H2Synonyms: 4-bromomethyl-2'-(N-trityltetrazol-5-yl)biphenyl | 5-(4'-(Bromomethyl)(1,1'-biphenyl)-2-yl)-1-trityl-1h-tetraazole | ...
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Kaempferol 7-O-β -D-glucopyranosideCas#: 16290-07-6 Compound CID: 10095180Formula: C21H20O11 Molecular Weight: 448.38IUPAC Name: 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-oneSMILES: C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)OInChIKey: YPWHZCPMOQGCDQ-HMGRVEAOSA-NInChI: InChI=1S/C21H20O11/c22-7-13-15(25)17(27)19(29)21(32-13)30-10-5-11(24)14-12(6-10)31-20(18(28)16(14)26)8-1-3-9(23)4-2-8/h1-6,13,15,17,19,21-25,27-29H,7H2/t13-,15-,17+,19-,21-/m1/s1Synonyms: kaempferol 7-O-beta-glucoside | HY-N0627 | Q3266683 | A-D-glucopyranoside | CHEBI:75790 | AKOS016004615 | DTXSID30102...
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6-Iodo-1,2,4-triazolo[1,5-a]pyridine, 97%Cas#: 614750-84-4 Compound CID: 17750141Formula: C6H4IN3 Molecular Weight: 245.02IUPAC Name: 6-iodo-[1,2,4]triazolo[1,5-a]pyridineSMILES: C1=CC2=NC=NN2C=C1IInChIKey: CDWWPXNAXCMGFV-UHFFFAOYSA-NInChI: InChI=1S/C6H4IN3/c7-5-1-2-6-8-4-9-10(6)3-5/h1-4HSynonyms: 6-Iodo-[1,2,4]triazolo[1,5-a]pyridine|614750-84-4|6-iodo[1,2,4]triazolo[1,5-a]pyridine|6-Iodo-[1,2,4]Triazolo[1,5,A]P...
