General Information of the Compound
| Compound ID |
CP0281967
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| Compound Name |
2-amino-5-(1-cyclopentylpyrazol-4-yl)-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
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| Structure |
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| Formula |
C22H23N7O
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| Molecular Weight |
401.474
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| Canonical SMILES |
CN1C(N)=NC(C1=O)(c1cnn(c1)C1CCCC1)c1cccc(c1)-c1cncnc1
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| InChI |
InChI=1S/C22H23N7O/c1-28-20(30)22(27-21(28)23,18-12-26-29(13-18)19-7-2-3-8-19)17-6-4-5-15(9-17)16-10-24-14-25-11-16/h4-6,9-14,19H,2-3,7-8H2,1H3,(H2,23,27)
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| InChIKey |
RSBLHFREHLCSDX-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