General Information of the Compound
| Compound ID |
CP0944283
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| Compound Name |
N-(2-(1H-indol-3-yl)ethyl)-N,5-dimethyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C23H24N6O2
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| Molecular Weight |
416.485
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| Canonical SMILES |
Cc1c(C(=O)N(C)CCc2c[nH]c3ccccc23)cnn1-c1nc2c(c(=O)[nH]1)CCC2
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| InChI |
InChI=1S/C23H24N6O2/c1-14-18(13-25-29(14)23-26-20-9-5-7-17(20)21(30)27-23)22(31)28(2)11-10-15-12-24-19-8-4-3-6-16(15)19/h3-4,6,8,12-13,24H,5,7,9-11H2,1-2H3,(H,26,27,30)
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| InChIKey |
DTFYVPQGYVIKJQ-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