General Information of the Compound
| Compound ID |
CP0471035
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| Compound Name |
3-benzoyl-N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
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| Structure |
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| Formula |
C27H30N4O2
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| Molecular Weight |
442.563
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| Canonical SMILES |
CC(C)Cc1cc(CNC(=O)C2C3CN(CC23)C(=O)c2ccccc2)nn1-c1ccccc1
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| InChI |
InChI=1S/C27H30N4O2/c1-18(2)13-22-14-20(29-31(22)21-11-7-4-8-12-21)15-28-26(32)25-23-16-30(17-24(23)25)27(33)19-9-5-3-6-10-19/h3-12,14,18,23-25H,13,15-17H2,1-2H3,(H,28,32)
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| InChIKey |
AJDSKTXYDMITDW-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