General Information of the Compound
| Compound ID |
CP0738386
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| Compound Name |
2-(5-methyl-4-(4-propionylpiperidine-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 |
C20H25N5O3
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| Molecular Weight |
383.452
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| Canonical SMILES |
CCC(=O)C1CCN(C(=O)c2cnn(-c3nc4c(c(=O)[nH]3)CCC4)c2C)CC1
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| InChI |
InChI=1S/C20H25N5O3/c1-3-17(26)13-7-9-24(10-8-13)19(28)15-11-21-25(12(15)2)20-22-16-6-4-5-14(16)18(27)23-20/h11,13H,3-10H2,1-2H3,(H,22,23,27)
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| InChIKey |
GGXQIIXAAXNNOL-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