General Information of the Compound
| Compound ID |
CP0513791
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| Compound Name |
1-[(4-bromophenyl)carbamoylamino]-N-(6-chloropyridin-3-yl)cyclopentane-1-carboxamide
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| Formula |
C18H18BrClN4O2
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| Molecular Weight |
437.725
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| Canonical SMILES |
Clc1ccc(NC(=O)C2(CCCC2)NC(=O)Nc2ccc(Br)cc2)cn1
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| InChI |
InChI=1S/C18H18BrClN4O2/c19-12-3-5-13(6-4-12)23-17(26)24-18(9-1-2-10-18)16(25)22-14-7-8-15(20)21-11-14/h3-8,11H,1-2,9-10H2,(H,22,25)(H2,23,24,26)
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| InChIKey |
LAJSDILOFSXBGI-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