General Information of the Compound
| Compound ID |
CP0527826
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| Compound Name |
1'-acetyl-N-benzyl-2-cyclopropyl-1-(4-fluorophenyl)sulfonylspiro[2H-indole-3,4'-piperidine]-5-carboxamide
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| Structure |
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| Formula |
C31H32FN3O4S
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| Molecular Weight |
561.679
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| Canonical SMILES |
CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccccc1)S(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C31H32FN3O4S/c1-21(36)34-17-15-31(16-18-34)27-19-24(30(37)33-20-22-5-3-2-4-6-22)9-14-28(27)35(29(31)23-7-8-23)40(38,39)26-12-10-25(32)11-13-26/h2-6,9-14,19,23,29H,7-8,15-18,20H2,1H3,(H,33,37)
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| InChIKey |
BFMVYRFOOILUJA-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