General Information of the Compound
| Compound ID |
CP0424380
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| Compound Name |
4-(((3-chloro-4-(4-chlorophenoxy)phenyl)(4-phenylthiazol-2-yl)amino)methyl)-N-(1H-tetrazol-5-yl)benzamide
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| Structure |
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| Formula |
C30H21Cl2N7O2S
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| Molecular Weight |
614.518
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| Canonical SMILES |
Clc1ccc(Oc2ccc(cc2Cl)N(Cc2ccc(cc2)C(=O)Nc2nnn[nH]2)c2nc(cs2)-c2ccccc2)cc1
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| InChI |
InChI=1S/C30H21Cl2N7O2S/c31-22-10-13-24(14-11-22)41-27-15-12-23(16-25(27)32)39(30-33-26(18-42-30)20-4-2-1-3-5-20)17-19-6-8-21(9-7-19)28(40)34-29-35-37-38-36-29/h1-16,18H,17H2,(H2,34,35,36,37,38,40)
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| InChIKey |
RFUJVVZCTSUHLM-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound