General Information of the Compound
| Compound ID |
CP0562434
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| Compound Name |
2-oxo-2-[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)acetamide
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| Structure |
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| Formula |
C28H29F3N4O2
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| Molecular Weight |
510.56
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| Canonical SMILES |
FC(F)(F)c1c(cnn1-c1ccccc1)C(=O)C(=O)NCCCN1CCC2(CCc3ccccc23)CC1
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| InChI |
InChI=1S/C28H29F3N4O2/c29-28(30,31)25-22(19-33-35(25)21-8-2-1-3-9-21)24(36)26(37)32-15-6-16-34-17-13-27(14-18-34)12-11-20-7-4-5-10-23(20)27/h1-5,7-10,19H,6,11-18H2,(H,32,37)
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| InChIKey |
CZWFBIJIVQEVBG-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