General Information of the Compound
| Compound ID |
CP0956789
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| Compound Name |
3-isopropyl-1-methyl-4-(3-(1-(pyridin-3-ylmethyl)-1H-pyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl)piperazin-2-one
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| Structure |
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| Formula |
C23H26N8O
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| Molecular Weight |
430.516
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| Canonical SMILES |
CC(C)C1C(=O)N(C)CCN1c1ccc2[nH]nc(-c3cnn(Cc4cccnc4)c3)c2n1
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| InChI |
InChI=1S/C23H26N8O/c1-15(2)22-23(32)29(3)9-10-31(22)19-7-6-18-21(26-19)20(28-27-18)17-12-25-30(14-17)13-16-5-4-8-24-11-16/h4-8,11-12,14-15,22H,9-10,13H2,1-3H3,(H,27,28)
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| InChIKey |
ZOPFZXGPYAKREV-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