General Information of the Compound
| Compound ID |
CP0839329
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| Compound Name |
2-(5-methyl-4-(octahydro-2H-pyrano[3,2-c]pyridine-6-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 |
Cc1c(C(=O)N2CCC3OCCCC3C2)cnn1-c1nc2c(c(=O)[nH]1)CCC2
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| InChI |
InChI=1S/C20H25N5O3/c1-12-15(19(27)24-8-7-17-13(11-24)4-3-9-28-17)10-21-25(12)20-22-16-6-2-5-14(16)18(26)23-20/h10,13,17H,2-9,11H2,1H3,(H,22,23,26)
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| InChIKey |
NJCFUVHZGZOATN-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