General Information of the Compound
| Compound ID |
CP0022961
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| Compound Name |
(3-methoxyazetidin-1-yl)-[3-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]-2H-indazol-5-yl]methanone
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| Structure |
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| Formula |
C23H23N5O2
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| Molecular Weight |
401.47
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| Canonical SMILES |
COC1CN(C1)C(=O)c1ccc2[nH]nc(Cc3ccc(cc3)-c3cnn(C)c3)c2c1
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| InChI |
InChI=1S/C23H23N5O2/c1-27-12-18(11-24-27)16-5-3-15(4-6-16)9-22-20-10-17(7-8-21(20)25-26-22)23(29)28-13-19(14-28)30-2/h3-8,10-12,19H,9,13-14H2,1-2H3,(H,25,26)
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| InChIKey |
IIIQUEYXCDAEGD-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