General Information of the Compound
| Compound ID |
CP0418127
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| Compound Name |
US9169224, 32
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| Structure |
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| Formula |
C21H27N3O
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| Molecular Weight |
337.467
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| Canonical SMILES |
CC(C)c1ccc(CN2CCN(CC2)C(=O)Nc2ccccc2)cc1
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| InChI |
InChI=1S/C21H27N3O/c1-17(2)19-10-8-18(9-11-19)16-23-12-14-24(15-13-23)21(25)22-20-6-4-3-5-7-20/h3-11,17H,12-16H2,1-2H3,(H,22,25)
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| InChIKey |
PUDRQRBGDLVLOD-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