General Information of the Compound
| Compound ID |
CP0414651
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| Compound Name |
3-[(4-fluorobenzoyl)amino]-4-[4-(2-methylphenyl)piperazin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
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| Structure |
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| Formula |
C32H36FN5O3
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| Molecular Weight |
557.67
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| Canonical SMILES |
Cc1ccccc1N1CCN(CC1)c1ccc(cc1NC(=O)c1ccc(F)cc1)C(=O)NCCCN1CCCC1=O
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| InChI |
InChI=1S/C32H36FN5O3/c1-23-6-2-3-7-28(23)36-18-20-37(21-19-36)29-14-11-25(31(40)34-15-5-17-38-16-4-8-30(38)39)22-27(29)35-32(41)24-9-12-26(33)13-10-24/h2-3,6-7,9-14,22H,4-5,8,15-21H2,1H3,(H,34,40)(H,35,41)
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| InChIKey |
AFQSZNHCXMNOHB-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