General Information of the Compound
| Compound ID |
CP0408323
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| Compound Name |
4'-(4-bromophenyl)-1-(propan-2-yl)-8'-oxa-5',6'-diazaspiro[piperidine-4,7'-tricyclo[7.4.0.0^{2,6}]tridecane]-1'(13'),4',9',11'-tetraene
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| Structure |
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| Formula |
C23H26BrN3O
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| Molecular Weight |
440.385
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| Canonical SMILES |
CC(C)N1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(Br)cc1
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| InChI |
InChI=1S/C23H26BrN3O/c1-16(2)26-13-11-23(12-14-26)27-21(19-5-3-4-6-22(19)28-23)15-20(25-27)17-7-9-18(24)10-8-17/h3-10,16,21H,11-15H2,1-2H3
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| InChIKey |
FBULPKPHMSLOMY-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