General Information of the Compound
| Compound ID |
CP0507469
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| Compound Name |
1-[3-chloro-4-[3-(pyrrolidine-1-carbonyl)-1H-indazol-6-yl]phenyl]-3-methylpyridin-2-one
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| Formula |
C24H21ClN4O2
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| Molecular Weight |
432.911
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| Canonical SMILES |
Cc1cccn(-c2ccc(c(Cl)c2)-c2ccc3c(n[nH]c3c2)C(=O)N2CCCC2)c1=O
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| InChI |
InChI=1S/C24H21ClN4O2/c1-15-5-4-12-29(23(15)30)17-7-9-18(20(25)14-17)16-6-8-19-21(13-16)26-27-22(19)24(31)28-10-2-3-11-28/h4-9,12-14H,2-3,10-11H2,1H3,(H,26,27)
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| InChIKey |
LRVSMUASUTVQFF-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