General Information of the Compound
| Compound ID |
CP0496482
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| Compound Name |
N-[[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazol-3-yl]methyl]cyclopentanamine
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| Structure |
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| Formula |
C21H20Cl3N3
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| Molecular Weight |
420.771
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| Canonical SMILES |
Clc1ccc(cc1)-c1cc(CNC2CCCC2)nn1-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C21H20Cl3N3/c22-15-7-5-14(6-8-15)21-12-18(13-25-17-3-1-2-4-17)26-27(21)20-10-9-16(23)11-19(20)24/h5-12,17,25H,1-4,13H2
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| InChIKey |
GGVCYYQZZRTFSO-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