General Information of the Compound
| Compound ID |
CP0571690
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| Compound Name |
N-[(3S)-1-(cyclobutylamino)-1-oxo-5-piperidin-1-ylpentan-3-yl]-1-cyclopentyl-5-phenylpyrazole-3-carboxamide
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| Structure |
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| Formula |
C29H41N5O2
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| Molecular Weight |
491.68
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| Canonical SMILES |
O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2ccccc2)n(n1)C1CCCC1)NC1CCC1
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| InChI |
InChI=1S/C29H41N5O2/c35-28(30-23-12-9-13-23)20-24(16-19-33-17-7-2-8-18-33)31-29(36)26-21-27(22-10-3-1-4-11-22)34(32-26)25-14-5-6-15-25/h1,3-4,10-11,21,23-25H,2,5-9,12-20H2,(H,30,35)(H,31,36)/t24-/m0/s1
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| InChIKey |
KBMRWAYOMTYZEO-DEOSSOPVSA-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