General Information of the Compound
| Compound ID |
CP0838170
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| Compound Name |
(R)-2-(4-(octahydropyrrolo[1,2-a]pyrazine-2-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 |
C18H22N6O2
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| Molecular Weight |
354.414
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| Canonical SMILES |
O=C(c1cnn(-c2nc3c(c(=O)[nH]2)CCC3)c1)N1CCN2CCC[C@@H]2C1
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| InChI |
InChI=1S/C18H22N6O2/c25-16-14-4-1-5-15(14)20-18(21-16)24-10-12(9-19-24)17(26)23-8-7-22-6-2-3-13(22)11-23/h9-10,13H,1-8,11H2,(H,20,21,25)/t13-/m1/s1
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| InChIKey |
MTWSJPGKZCSSLO-CYBMUJFWSA-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