General Information of the Compound
| Compound ID |
CP0762706
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| Compound Name |
5-methyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-4-(4-(trifluoromethyl)piperidine-1-carbonyl)-1H-pyrazole-3-carboxamide
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| Structure |
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| Formula |
C19H21F3N6O3
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| Molecular Weight |
438.41
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| Canonical SMILES |
Cc1c(C(=O)N2CCC(C(F)(F)F)CC2)c(C(N)=O)nn1-c1nc2c(c(=O)[nH]1)CCC2
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| InChI |
InChI=1S/C19H21F3N6O3/c1-9-13(17(31)27-7-5-10(6-8-27)19(20,21)22)14(15(23)29)26-28(9)18-24-12-4-2-3-11(12)16(30)25-18/h10H,2-8H2,1H3,(H2,23,29)(H,24,25,30)
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| InChIKey |
GLMMFDNBWVECMO-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