General Information of the Compound
| Compound ID |
CP0562202
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| Compound Name |
5-[2-(4-indol-1-ylbutylcarbamoyl)phenyl]-N-(3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide
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| Formula |
C32H37N5O2
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| Molecular Weight |
523.681
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| Canonical SMILES |
O=C(NCCCN1CCCC1)c1cncc(c1)-c1ccccc1C(=O)NCCCCn1ccc2ccccc12
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| InChI |
InChI=1S/C32H37N5O2/c38-31(34-16-9-19-36-17-7-8-18-36)27-22-26(23-33-24-27)28-11-2-3-12-29(28)32(39)35-15-5-6-20-37-21-14-25-10-1-4-13-30(25)37/h1-4,10-14,21-24H,5-9,15-20H2,(H,34,38)(H,35,39)
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| InChIKey |
RNRRURXYRHFLCA-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