General Information of the Compound
| Compound ID |
CP0294462
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| Compound Name |
(1R,3S)-N-methyl-N-(4-phenylphenyl)-3-(propanoylamino)cyclopentane-1-carboxamide
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| Structure |
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| Formula |
C22H26N2O2
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| Molecular Weight |
350.462
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| Canonical SMILES |
CCC(=O)N[C@H]1CC[C@H](C1)C(=O)N(C)c1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C22H26N2O2/c1-3-21(25)23-19-12-9-18(15-19)22(26)24(2)20-13-10-17(11-14-20)16-7-5-4-6-8-16/h4-8,10-11,13-14,18-19H,3,9,12,15H2,1-2H3,(H,23,25)/t18-,19+/m1/s1
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| InChIKey |
PORBLGJUJCANDZ-MOPGFXCFSA-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