General Information of the Compound
| Compound ID |
CP0214827
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| Compound Name |
1-[2-(1'-propan-2-ylspiro[2H-indole-3,4'-piperidine]-1-yl)phenyl]-3-[4-(trifluoromethoxy)phenyl]urea
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| Structure |
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| Formula |
C29H31F3N4O2
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| Molecular Weight |
524.587
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| Canonical SMILES |
CC(C)N1CCC2(CN(c3ccccc23)c2ccccc2NC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1
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| InChI |
InChI=1S/C29H31F3N4O2/c1-20(2)35-17-15-28(16-18-35)19-36(25-9-5-3-7-23(25)28)26-10-6-4-8-24(26)34-27(37)33-21-11-13-22(14-12-21)38-29(30,31)32/h3-14,20H,15-19H2,1-2H3,(H2,33,34,37)
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| InChIKey |
ORQPOUPGRVZEJP-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