General Information of the Compound
| Compound ID |
CP0427735
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| Compound Name |
3-[(5-chloro-1H-indole-3-carbonyl)amino]benzoic acid
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| Structure |
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| Formula |
C16H11ClN2O3
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| Molecular Weight |
314.728
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| Canonical SMILES |
OC(=O)c1cccc(NC(=O)c2c[nH]c3ccc(Cl)cc23)c1
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| InChI |
InChI=1S/C16H11ClN2O3/c17-10-4-5-14-12(7-10)13(8-18-14)15(20)19-11-3-1-2-9(6-11)16(21)22/h1-8,18H,(H,19,20)(H,21,22)
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| InChIKey |
VRKFMHBODMUPES-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