General Information of the Compound
| Compound ID |
CP0399708
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| Compound Name |
1'-[(3-hydroxypyridin-2-yl)methyl]-1-quinolin-3-ylspiro[indole-3,4'-piperidine]-2-one
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| Structure |
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| Formula |
C27H24N4O2
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| Molecular Weight |
436.515
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| Canonical SMILES |
Oc1cccnc1CN1CCC2(CC1)C(=O)N(c1ccccc21)c1cnc2ccccc2c1
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| InChI |
InChI=1S/C27H24N4O2/c32-25-10-5-13-28-23(25)18-30-14-11-27(12-15-30)21-7-2-4-9-24(21)31(26(27)33)20-16-19-6-1-3-8-22(19)29-17-20/h1-10,13,16-17,32H,11-12,14-15,18H2
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| InChIKey |
NTCIRXMEJKSXTD-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