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2-Octyl-4-isothiazolin-3-oneCas#: 26530-20-1 Compound CID: 33528Formula: C11H19NOS Molecular Weight: 213.34IUPAC Name: 2-octyl-1,2-thiazol-3-oneSMILES: CCCCCCCCN1C(=O)C=CS1InChIKey: JPMIIZHYYWMHDT-UHFFFAOYSA-NInChI: InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3Synonyms: 2-n-Octyl-3-isothiazolone | 2-Octyl-3-isothiazolone | Kathon 893 | AS-11894 | Tox21_201459 | 2-Octyl-3-isothioazolone...
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TriadimenolCas#: 55219-65-3 Compound CID: 41368Formula: C14H18ClN3O2 Molecular Weight: 295.76IUPAC Name: 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-olSMILES: CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)Cl)OInChIKey: BAZVSMNPJJMILC-UHFFFAOYSA-NInChI: InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3Synonyms: NCGC00088160-03 | a-(4-chlorophenoxy)-b-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol | Baytan | DTXSID0032493 | NC...
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Hexachlorophene, Bacterial enoyl-[acyl-carrier-protein] reductase inhibitorCas#: 70-30-4 Compound CID: 3598Formula: CH2[C6H(Cl)3OH]2 Molecular Weight: 406.9IUPAC Name: 3,4,6-trichloro-2-[(2,3,5-trichloro-6-hydroxyphenyl)methyl]phenolSMILES: C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)ClInChIKey: ACGUYXCXAPNIKK-UHFFFAOYSA-NInChI: InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2Synonyms: 2,2'-methanediylbis(3,4,6-trichlorophenol) | hexachlorophene | IWW5FV6NK2 | 2,5,6-trichlorophenol) | 6,6'-Methylenebi...
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(-)-Epigallocatechin gallateCas#: 989-51-5 Compound CID: 65064Formula: C22H18O11 Molecular Weight: 458.37IUPAC Name: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoateSMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)OInChIKey: WMBWREPUVVBILR-WIYYLYMNSA-NInChI: InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21-/m1/s1Synonyms: EGCG | 3-O-Gallate
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2-Octyl-4-isothiazolin-3-oneCas#: 26530-20-1 Compound CID: 33528Formula: C11H19NOS Molecular Weight: 213.34IUPAC Name: 2-octyl-1,2-thiazol-3-oneSMILES: CCCCCCCCN1C(=O)C=CS1InChIKey: JPMIIZHYYWMHDT-UHFFFAOYSA-NInChI: InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3Synonyms: 2-n-Octyl-3-isothiazolone | 2-Octyl-3-isothiazolone | Kathon 893 | AS-11894 | Tox21_201459 | 2-Octyl-3-isothioazolone...
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BI-D1870, Inhibitor of ribosomal protein S6 kinase A1;Inhibitor of ribosomal protein S6 kinase A2;Inhibitor of ribosomal protein S6 kinase A3;Inhibitor of ribosomal protein S6 kinase A6Cas#: 501437-28-1 Compound CID: 25023738Formula: C19H23F2N5O2 Molecular Weight: 391.42IUPAC Name: 2-(3,5-difluoro-4-hydroxyanilino)-5,7-dimethyl-8-(3-methylbutyl)-7H-pteridin-6-oneSMILES: CC1C(=O)N(C2=CN=C(N=C2N1CCC(C)C)NC3=CC(=C(C(=C3)F)O)F)CInChIKey: DTEKTGDVSARYDS-UHFFFAOYSA-NInChI: InChI=1S/C19H23F2N5O2/c1-10(2)5-6-26-11(3)18(28)25(4)15-9-22-19(24-17(15)26)23-12-7-13(20)16(27)14(21)8-12/h7-11,27H,5-6H2,1-4H3,(H,22,23,24)Synonyms: AS-16192 | 2-Ethyl-2-phenyl-butyric acid 2-(2-diethylamino-ethoxy)-ethyl ester; compound with 3-carboxy-3-hydroxy-pe...