General Information of the Compound
| Compound ID |
CP0034610
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| Compound Name |
1-[(3-chlorophenyl)methyl]-4-(4,4-difluoropiperidin-1-yl)pyrrolo[3,2-c]quinoline
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| Structure |
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| Formula |
C23H20ClF2N3
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| Molecular Weight |
411.883
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| Canonical SMILES |
FC1(F)CCN(CC1)c1nc2ccccc2c2n(Cc3cccc(Cl)c3)ccc12
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| InChI |
InChI=1S/C23H20ClF2N3/c24-17-5-3-4-16(14-17)15-29-11-8-19-21(29)18-6-1-2-7-20(18)27-22(19)28-12-9-23(25,26)10-13-28/h1-8,11,14H,9-10,12-13,15H2
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| InChIKey |
PKKVQHSSLZVNAS-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