General Information of the Compound
| Compound ID |
CP0674914
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| Compound Name |
(Z)-3-({4-[(2-Imidazol-1-yl-acetyl)methylamino]-phenylamino}-phenyl-methylene)-2-oxo-2,3-dihydro-1H-indole-6-carboxylic acidMethyl Ester
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| Formula |
C29H25N5O4
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| Molecular Weight |
507.55
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| Canonical SMILES |
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N(C)C(=O)Cn2ccnc2)cc1)c1ccccc1
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| InChI |
InChI=1S/C29H25N5O4/c1-33(25(35)17-34-15-14-30-18-34)22-11-9-21(10-12-22)31-27(19-6-4-3-5-7-19)26-23-13-8-20(29(37)38-2)16-24(23)32-28(26)36/h3-16,18,31H,17H2,1-2H3,(H,32,36)/b27-26-
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| InChIKey |
FTERNYMEXWLTAM-RQZHXJHFSA-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