General Information of the Compound
| Compound ID |
CP0542674
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| Compound Name |
N-[3-(cyclopentylcarbamoyl)-1-methylpyrazol-4-yl]-6-[2-(cyclopropylmethylamino)pyridin-4-yl]pyridine-2-carboxamide
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| Structure |
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| Formula |
C25H29N7O2
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| Molecular Weight |
459.554
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| Canonical SMILES |
Cn1cc(NC(=O)c2cccc(n2)-c2ccnc(NCC3CC3)c2)c(n1)C(=O)NC1CCCC1
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| InChI |
InChI=1S/C25H29N7O2/c1-32-15-21(23(31-32)25(34)28-18-5-2-3-6-18)30-24(33)20-8-4-7-19(29-20)17-11-12-26-22(13-17)27-14-16-9-10-16/h4,7-8,11-13,15-16,18H,2-3,5-6,9-10,14H2,1H3,(H,26,27)(H,28,34)(H,30,33)
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| InChIKey |
TUIBFKUZSBQECN-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