General Information of the Compound
| Compound ID |
CP0261622
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| Compound Name |
2,2-bis(4-chlorophenyl)-N-[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]acetamide
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| Structure |
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| Formula |
C21H19Cl2N3O2
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| Molecular Weight |
416.308
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| Canonical SMILES |
Clc1ccc(cc1)C(C(=O)NCC(=O)N1CCC[C@H]1C#N)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H19Cl2N3O2/c22-16-7-3-14(4-8-16)20(15-5-9-17(23)10-6-15)21(28)25-13-19(27)26-11-1-2-18(26)12-24/h3-10,18,20H,1-2,11,13H2,(H,25,28)/t18-/m0/s1
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| InChIKey |
RJDRVPZZIUCYOD-SFHVURJKSA-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