General Information of the Compound
| Compound ID |
CP0955177
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| Compound Name |
6-methyl-2-(3-(2-methylindoline-1-carbonyl)-1H-pyrazol-1-yl)pyrimidin-4(3H)-one
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| Structure |
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| Formula |
C18H17N5O2
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| Molecular Weight |
335.367
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| Canonical SMILES |
Cc1cc(=O)[nH]c(-n2ccc(C(=O)N3c4ccccc4CC3C)n2)n1
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| InChI |
InChI=1S/C18H17N5O2/c1-11-9-16(24)20-18(19-11)22-8-7-14(21-22)17(25)23-12(2)10-13-5-3-4-6-15(13)23/h3-9,12H,10H2,1-2H3,(H,19,20,24)
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| InChIKey |
ZTHQGONJXBLVPJ-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