General Information of the Compound
| Compound ID |
CP0048211
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| Compound Name |
3-cyclopropyl-2-(4-ethyl-5-fluoropyridin-3-yl)-6-fluoroimidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C17H15F2N3
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| Molecular Weight |
299.324
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| Canonical SMILES |
CCc1c(F)cncc1-c1nc2ccc(F)cn2c1C1CC1
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| InChI |
InChI=1S/C17H15F2N3/c1-2-12-13(7-20-8-14(12)19)16-17(10-3-4-10)22-9-11(18)5-6-15(22)21-16/h5-10H,2-4H2,1H3
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| InChIKey |
WWCCZWUYPUNELD-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