General Information of the Compound
| Compound ID |
CP0575127
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| Compound Name |
(E)-N-(2-aminophenyl)-3-[2-(1H-indol-6-yl)-1,3-thiazol-5-yl]prop-2-enamide
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| Structure |
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| Formula |
C20H16N4OS
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| Molecular Weight |
360.442
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| Canonical SMILES |
Nc1ccccc1NC(=O)\C=C\c1cnc(s1)-c1ccc2cc[nH]c2c1
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| InChI |
InChI=1S/C20H16N4OS/c21-16-3-1-2-4-17(16)24-19(25)8-7-15-12-23-20(26-15)14-6-5-13-9-10-22-18(13)11-14/h1-12,22H,21H2,(H,24,25)/b8-7+
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| InChIKey |
RSVNFRRFTRLZNG-BQYQJAHWSA-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