General Information of the Compound
| Compound ID |
CP0667085
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| Compound Name |
2-(5-(1-cyclopropyl-5,6-difluoro-1H-benzo[d]imidazol-2-yl)pyridin-3-yl)propan-2-ol
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| Structure |
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| Formula |
C18H17F2N3O
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| Molecular Weight |
329.35
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| Canonical SMILES |
CC(C)(O)c1cncc(-c2nc3cc(F)c(F)cc3n2C2CC2)c1
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| InChI |
InChI=1S/C18H17F2N3O/c1-18(2,24)11-5-10(8-21-9-11)17-22-15-6-13(19)14(20)7-16(15)23(17)12-3-4-12/h5-9,12,24H,3-4H2,1-2H3
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| InChIKey |
CAFMTLCLARMZDZ-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
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial
Protein ID: PT01584, Steroid 17-alpha-hydroxylase/17,20 lyase
Protein ID: PT05184, Steroid 21-hydroxylase