General Information of the Compound
| Compound ID |
CP0456146
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| Compound Name |
N-[[6-[3-(oxan-4-yl)propanoyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
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| Structure |
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| Formula |
C24H34N4O3
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| Molecular Weight |
426.561
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| Canonical SMILES |
O=C(CCC1CCOCC1)N1CCC2(CC2CNC(=O)N2Cc3ccncc3C2)CC1
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| InChI |
InChI=1S/C24H34N4O3/c29-22(2-1-18-4-11-31-12-5-18)27-9-6-24(7-10-27)13-21(24)15-26-23(30)28-16-19-3-8-25-14-20(19)17-28/h3,8,14,18,21H,1-2,4-7,9-13,15-17H2,(H,26,30)
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| InChIKey |
GDZBTZPHHNUXKZ-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