General Information of the Compound
| Compound ID |
CP0538596
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| Compound Name |
1-(3,4-dimethoxyphenyl)-N-[3-(5-methylimidazol-1-yl)propyl]cyclopentane-1-carboxamide
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| Structure |
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| Formula |
C21H29N3O3
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| Molecular Weight |
371.481
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| Canonical SMILES |
COc1ccc(cc1OC)C1(CCCC1)C(=O)NCCCn1cncc1C
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| InChI |
InChI=1S/C21H29N3O3/c1-16-14-22-15-24(16)12-6-11-23-20(25)21(9-4-5-10-21)17-7-8-18(26-2)19(13-17)27-3/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,23,25)
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| InChIKey |
LVHZSWHCVCDPSN-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