General Information of the Compound
| Compound ID |
CP0761050
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| Compound Name |
N-(2,3-dihydro-1H-inden-1-yl)-N,5-dimethyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C20H21N5O2
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| Molecular Weight |
363.421
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| Canonical SMILES |
Cc1cc(=O)[nH]c(-n2ncc(C(=O)N(C)C3CCc4ccccc43)c2C)n1
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| InChI |
InChI=1S/C20H21N5O2/c1-12-10-18(26)23-20(22-12)25-13(2)16(11-21-25)19(27)24(3)17-9-8-14-6-4-5-7-15(14)17/h4-7,10-11,17H,8-9H2,1-3H3,(H,22,23,26)
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| InChIKey |
JLMVCSCQOLCBQN-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