General Information of the Compound
| Compound ID |
CP0812544
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| Compound Name |
(R)-2-(5-methyl-4-(3-(methylamino)pyrrolidine-1-carbonyl)-1H-pyrazol-1-yl)-6,7-dihydro-3H-cyclopenta[d]pyrimidin-4(5H)-one
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| Structure |
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| Formula |
C17H22N6O2
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| Molecular Weight |
342.403
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| Canonical SMILES |
CN[C@@H]1CCN(C(=O)c2cnn(-c3nc4c(c(=O)[nH]3)CCC4)c2C)C1
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| InChI |
InChI=1S/C17H22N6O2/c1-10-13(16(25)22-7-6-11(9-22)18-2)8-19-23(10)17-20-14-5-3-4-12(14)15(24)21-17/h8,11,18H,3-7,9H2,1-2H3,(H,20,21,24)/t11-/m1/s1
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| InChIKey |
XVPPUSWYKYTBRC-LLVKDONJSA-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