General Information of the Compound
| Compound ID |
CP0550099
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| Compound Name |
N-[(3S)-1-(cyclobutylamino)-1-oxo-5-piperidin-1-ylpentan-3-yl]-1-cyclopentyl-5-pyridin-2-ylpyrazole-3-carboxamide
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| Structure |
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| Formula |
C28H40N6O2
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| Molecular Weight |
492.668
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| Canonical SMILES |
O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2ccccn2)n(n1)C1CCCC1)NC1CCC1
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| InChI |
InChI=1S/C28H40N6O2/c35-27(30-21-9-8-10-21)19-22(14-18-33-16-6-1-7-17-33)31-28(36)25-20-26(24-13-4-5-15-29-24)34(32-25)23-11-2-3-12-23/h4-5,13,15,20-23H,1-3,6-12,14,16-19H2,(H,30,35)(H,31,36)/t22-/m0/s1
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| InChIKey |
ARLHVSQJEYMUOQ-QFIPXVFZSA-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