General Information of the Compound
| Compound ID |
CP0487090
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| Compound Name |
4-(4-chlorophenyl)-N-methyl-N-[2-[4-(pyrrolidin-1-ylmethyl)phenyl]ethyl]benzamide
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| Structure |
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| Formula |
C27H29ClN2O
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| Molecular Weight |
432.995
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| Canonical SMILES |
CN(CCc1ccc(CN2CCCC2)cc1)C(=O)c1ccc(cc1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C27H29ClN2O/c1-29(19-16-21-4-6-22(7-5-21)20-30-17-2-3-18-30)27(31)25-10-8-23(9-11-25)24-12-14-26(28)15-13-24/h4-15H,2-3,16-20H2,1H3
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| InChIKey |
COUOZMRGIPSPOI-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