General Information of the Compound
| Compound ID |
CP0734254
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| Compound Name |
2-(4-(4-methoxypiperidine-1-carbonyl)-5-methyl-1H-pyrazol-1-yl)-6,7-dihydro-3H-cyclopenta[d]pyrimidin-4(5H)-one
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| Structure |
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| Formula |
C18H23N5O3
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| Molecular Weight |
357.414
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| Canonical SMILES |
COC1CCN(C(=O)c2cnn(-c3nc4c(c(=O)[nH]3)CCC4)c2C)CC1
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| InChI |
InChI=1S/C18H23N5O3/c1-11-14(17(25)22-8-6-12(26-2)7-9-22)10-19-23(11)18-20-15-5-3-4-13(15)16(24)21-18/h10,12H,3-9H2,1-2H3,(H,20,21,24)
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| InChIKey |
PXEXOYXTWOQNKO-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