General Information of the Compound
| Compound ID |
CP0546510
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| Compound Name |
N-[(3S)-1-(cyclobutylamino)-1-oxo-5-piperidin-1-ylpentan-3-yl]-1-cyclopentyl-5-(2-propan-2-ylphenyl)pyrazole-3-carboxamide
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| Structure |
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| Formula |
C32H47N5O2
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| Molecular Weight |
533.761
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| Canonical SMILES |
CC(C)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1
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| InChI |
InChI=1S/C32H47N5O2/c1-23(2)27-15-6-7-16-28(27)30-22-29(35-37(30)26-13-4-5-14-26)32(39)34-25(17-20-36-18-8-3-9-19-36)21-31(38)33-24-11-10-12-24/h6-7,15-16,22-26H,3-5,8-14,17-21H2,1-2H3,(H,33,38)(H,34,39)/t25-/m0/s1
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| InChIKey |
SELLQIPQHMKOFY-VWLOTQADSA-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