General Information of the Compound
| Compound ID |
CP0565051
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| Compound Name |
4-chloro-N-((R)-cyclo- propyl((1R,3s,5S,6r)-3- (5,6-difluoro-1H-benzo[d]- imidazol-1-yl)- bicyclo[3.1.0]hexan-6- yl)methyl)benzamide
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| Formula |
C24H22ClF2N3O
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| Molecular Weight |
441.909
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| Canonical SMILES |
Fc1cc2ncn([C@H]3C[C@H]4[C@@H](C3)[C@@H]4[C@H](NC(=O)c3ccc(Cl)cc3)C3CC3)c2cc1F
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| InChI |
InChI=1S/C24H22ClF2N3O/c25-14-5-3-13(4-6-14)24(31)29-23(12-1-2-12)22-16-7-15(8-17(16)22)30-11-28-20-9-18(26)19(27)10-21(20)30/h3-6,9-12,15-17,22-23H,1-2,7-8H2,(H,29,31)/t15-,16-,17+,22+,23-/m1/s1
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| InChIKey |
APCGWDFDSUEECQ-XASPMJECSA-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