General Information of the Compound
| Compound ID |
CP0414401
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| Compound Name |
3-cyclopropyl-2-[5-[(2S)-1,1,1-trifluoro-2-hydroxypropan-2-yl]pyridin-3-yl]imidazo[1,2-a]pyridine-6-carbonitrile
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| Structure |
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| Formula |
C19H15F3N4O
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| Molecular Weight |
372.35
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| Canonical SMILES |
C[C@](O)(c1cncc(c1)-c1nc2ccc(cn2c1C1CC1)C#N)C(F)(F)F
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| InChI |
InChI=1S/C19H15F3N4O/c1-18(27,19(20,21)22)14-6-13(8-24-9-14)16-17(12-3-4-12)26-10-11(7-23)2-5-15(26)25-16/h2,5-6,8-10,12,27H,3-4H2,1H3/t18-/m0/s1
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| InChIKey |
GEQUZEFCHLVDGF-SFHVURJKSA-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