General Information of the Compound
| Compound ID |
CP0411032
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| Compound Name |
1-(1-azabicyclo[2.2.2]octan-3-ylmethyl)-4-(1H-indol-4-yl)quinolin-2-one
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| Structure |
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| Formula |
C25H25N3O
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| Molecular Weight |
383.495
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| Canonical SMILES |
O=c1cc(-c2cccc3[nH]ccc23)c2ccccc2n1CC1CN2CCC1CC2
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| InChI |
InChI=1S/C25H25N3O/c29-25-14-22(19-5-3-6-23-20(19)8-11-26-23)21-4-1-2-7-24(21)28(25)16-18-15-27-12-9-17(18)10-13-27/h1-8,11,14,17-18,26H,9-10,12-13,15-16H2
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| InChIKey |
IOTQYEJCFAERLM-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