General Information of the Compound
| Compound ID |
CP0018236
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| Compound Name |
2-(4-Phenyl-1H-pyrazol-3-yl)-1H-indole-6-carboxylic acid(5-methyl-isoxazol-4-ylmethyl)-amide
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| Structure |
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| Formula |
C23H19N5O2
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| Molecular Weight |
397.438
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| Canonical SMILES |
Cc1oncc1CNC(=O)c1ccc2cc([nH]c2c1)-c1n[nH]cc1-c1ccccc1
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| InChI |
InChI=1S/C23H19N5O2/c1-14-18(12-26-30-14)11-24-23(29)17-8-7-16-9-21(27-20(16)10-17)22-19(13-25-28-22)15-5-3-2-4-6-15/h2-10,12-13,27H,11H2,1H3,(H,24,29)(H,25,28)
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| InChIKey |
XLUGFNKYTODIAP-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