General Information of the Compound
| Compound ID |
CP0462378
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| Compound Name |
tert-butyl 4-[3-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)propyl]-4-phenylpiperidine-1-carboxylate
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| Structure |
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| Formula |
C32H44N4O3
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| Molecular Weight |
532.729
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(CCCN2CCC3(CC2)N(CNC3=O)c2ccccc2)(CC1)c1ccccc1
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| InChI |
InChI=1S/C32H44N4O3/c1-30(2,3)39-29(38)35-23-16-31(17-24-35,26-11-6-4-7-12-26)15-10-20-34-21-18-32(19-22-34)28(37)33-25-36(32)27-13-8-5-9-14-27/h4-9,11-14H,10,15-25H2,1-3H3,(H,33,37)
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| InChIKey |
CIVXUIZMHXDXKK-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