General Information of the Compound
| Compound ID |
CP0406740
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| Compound Name |
(4S)-4-(4-fluorophenyl)-N-[1-(2-hydroxyethyl)-5-methylindazol-6-yl]-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
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| Structure |
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| Formula |
C22H21FN4O3
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| Molecular Weight |
408.433
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| Canonical SMILES |
Cc1cc2cnn(CCO)c2cc1NC(=O)C1=CNC(=O)C[C@H]1c1ccc(F)cc1
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| InChI |
InChI=1S/C22H21FN4O3/c1-13-8-15-11-25-27(6-7-28)20(15)10-19(13)26-22(30)18-12-24-21(29)9-17(18)14-2-4-16(23)5-3-14/h2-5,8,10-12,17,28H,6-7,9H2,1H3,(H,24,29)(H,26,30)/t17-/m0/s1
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| InChIKey |
GARXFKOAJYYJSB-KRWDZBQOSA-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