General Information of the Compound
| Compound ID |
CP0382611
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| Compound Name |
(R)-4-(6-(2-(2-methylpiperidin-1-yl)ethyl)naphthalen-2-yl)benzonitrile
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| Structure |
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| Formula |
C25H26N2
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| Molecular Weight |
354.497
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| Canonical SMILES |
C[C@@H]1CCCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
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| InChI |
InChI=1S/C25H26N2/c1-19-4-2-3-14-27(19)15-13-20-5-10-25-17-24(12-11-23(25)16-20)22-8-6-21(18-26)7-9-22/h5-12,16-17,19H,2-4,13-15H2,1H3/t19-/m1/s1
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| InChIKey |
ZXKMLLOCABBRCL-LJQANCHMSA-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