General Information of the Compound
| Compound ID |
CP0561714
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| Compound Name |
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-3-(2-oxopyrrolidin-1-yl)benzamide
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| Structure |
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| Formula |
C21H21FN2O2
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| Molecular Weight |
352.409
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| Canonical SMILES |
Fc1ccc(CN(C2CC2)C(=O)c2cccc(c2)N2CCCC2=O)cc1
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| InChI |
InChI=1S/C21H21FN2O2/c22-17-8-6-15(7-9-17)14-24(18-10-11-18)21(26)16-3-1-4-19(13-16)23-12-2-5-20(23)25/h1,3-4,6-9,13,18H,2,5,10-12,14H2
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| InChIKey |
GJVSJRPGZGZHDV-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