General Information of the Compound
| Compound ID |
CP0542585
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| Compound Name |
1-[(3-methylpyridin-2-yl)methyl]-1'-(4-phenylphenyl)spiro[piperidine-4,3'-pyrrolo[3,2-b]pyridine]-2'-one
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| Structure |
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| Formula |
C30H28N4O
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| Molecular Weight |
460.581
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| Canonical SMILES |
Cc1cccnc1CN1CCC2(CC1)C(=O)N(c1cccnc21)c1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C30H28N4O/c1-22-7-5-17-31-26(22)21-33-19-15-30(16-20-33)28-27(10-6-18-32-28)34(29(30)35)25-13-11-24(12-14-25)23-8-3-2-4-9-23/h2-14,17-18H,15-16,19-21H2,1H3
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| InChIKey |
GUAQUNKDLJZDKS-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