General Information of the Compound
| Compound ID |
CP0042484
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| Compound Name |
N,N-diethyl-4-[(3-methoxyphenyl)-[8-(2-phenylethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]methyl]benzamide
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| Structure |
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| Formula |
C34H40N2O2
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| Molecular Weight |
508.706
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| Canonical SMILES |
CCN(CC)C(=O)c1ccc(cc1)C(=C1CC2CCC(C1)N2CCc1ccccc1)c1cccc(OC)c1
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| InChI |
InChI=1S/C34H40N2O2/c1-4-35(5-2)34(37)27-16-14-26(15-17-27)33(28-12-9-13-32(24-28)38-3)29-22-30-18-19-31(23-29)36(30)21-20-25-10-7-6-8-11-25/h6-17,24,30-31H,4-5,18-23H2,1-3H3
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| InChIKey |
BPBXLBMJYVSLOP-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