General Information of the Compound
| Compound ID |
CP0436083
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| Compound Name |
3-phenyl-4-[(5R)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]benzonitrile
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| Structure |
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| Formula |
C20H17N3
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| Molecular Weight |
299.377
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| Canonical SMILES |
N#Cc1ccc([C@H]2CCCc3cncn23)c(c1)-c1ccccc1
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| InChI |
InChI=1S/C20H17N3/c21-12-15-9-10-18(19(11-15)16-5-2-1-3-6-16)20-8-4-7-17-13-22-14-23(17)20/h1-3,5-6,9-11,13-14,20H,4,7-8H2/t20-/m1/s1
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| InChIKey |
INZQCVVDTIOFTJ-HXUWFJFHSA-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