General Information of the Compound
| Compound ID |
CP0531894
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| Compound Name |
1-methyl-5-(2-piperidin-4-ylindazol-5-yl)pyridin-2-one
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| Structure |
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| Formula |
C18H20N4O
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| Molecular Weight |
308.385
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| Canonical SMILES |
Cn1cc(ccc1=O)-c1ccc2nn(cc2c1)C1CCNCC1
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| InChI |
InChI=1S/C18H20N4O/c1-21-11-14(3-5-18(21)23)13-2-4-17-15(10-13)12-22(20-17)16-6-8-19-9-7-16/h2-5,10-12,16,19H,6-9H2,1H3
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| InChIKey |
MLKBGDCBWCEUKC-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