General Information of the Compound
| Compound ID |
CP0275440
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| Compound Name |
N,N-diethyl-4-[phenyl-(8-propyl-8-azabicyclo[3.2.1]octan-3-ylidene)methyl]benzamide
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| Structure |
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| Formula |
C28H36N2O
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| Molecular Weight |
416.609
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| Canonical SMILES |
CCCN1C2CCC1CC(C2)=C(c1ccccc1)c1ccc(cc1)C(=O)N(CC)CC
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| InChI |
InChI=1S/C28H36N2O/c1-4-18-30-25-16-17-26(30)20-24(19-25)27(21-10-8-7-9-11-21)22-12-14-23(15-13-22)28(31)29(5-2)6-3/h7-15,25-26H,4-6,16-20H2,1-3H3
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| InChIKey |
CLYBTDNNANXCCM-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