General Information of the Compound
| Compound ID |
CP0867626
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| Compound Name |
4-(4-(5-isopropoxy-1H-indazol-3-yl)pyridin-2-yl)-1-methylpiperazin-2-one
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| Structure |
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| Formula |
C20H23N5O2
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| Molecular Weight |
365.437
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| Canonical SMILES |
CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCN(C)C(=O)C4)c3)c2c1
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| InChI |
InChI=1S/C20H23N5O2/c1-13(2)27-15-4-5-17-16(11-15)20(23-22-17)14-6-7-21-18(10-14)25-9-8-24(3)19(26)12-25/h4-7,10-11,13H,8-9,12H2,1-3H3,(H,22,23)
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| InChIKey |
VOBPFWQIRFFCBS-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