General Information of the Compound
| Compound ID |
CP0375229
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| Compound Name |
8-chloro-N-(4-cyanophenyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
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| Structure |
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| Formula |
C21H20ClN3O2
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| Molecular Weight |
381.863
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| Canonical SMILES |
Clc1cccc2CCC3(CCN(CC3)C(=O)Nc3ccc(cc3)C#N)Oc12
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| InChI |
InChI=1S/C21H20ClN3O2/c22-18-3-1-2-16-8-9-21(27-19(16)18)10-12-25(13-11-21)20(26)24-17-6-4-15(14-23)5-7-17/h1-7H,8-13H2,(H,24,26)
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| InChIKey |
MIAPWXITKNBFGI-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