General Information of the Compound
| Compound ID |
CP0966389
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| Compound Name |
2-(5-methyl-4-(1-(5-phenyl-1,3,4-oxadiazol-2-yl)-6-azaspiro[2.5]octane-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 |
C27H27N7O3
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| Molecular Weight |
497.559
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| Canonical SMILES |
Cc1c(C(=O)N2CCC3(CC2)CC3c2nnc(-c3ccccc3)o2)cnn1-c1nc2c(c(=O)[nH]1)CCC2
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| InChI |
InChI=1S/C27H27N7O3/c1-16-19(15-28-34(16)26-29-21-9-5-8-18(21)22(35)30-26)25(36)33-12-10-27(11-13-33)14-20(27)24-32-31-23(37-24)17-6-3-2-4-7-17/h2-4,6-7,15,20H,5,8-14H2,1H3,(H,29,30,35)
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| InChIKey |
QVMSRLZADTZAKV-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