General Information of the Compound
| Compound ID |
CP0485394
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| Compound Name |
4-(6-azabicyclo[3.2.1]octan-6-ylmethyl)-N-[2-(2-methoxyphenyl)ethyl]-N-pyrrolidin-3-ylbenzamide
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| Structure |
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| Formula |
C28H37N3O2
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| Molecular Weight |
447.623
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| Canonical SMILES |
COc1ccccc1CCN(C1CCNC1)C(=O)c1ccc(CN2CC3CC2CCC3)cc1
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| InChI |
InChI=1S/C28H37N3O2/c1-33-27-8-3-2-6-23(27)14-16-31(26-13-15-29-18-26)28(32)24-11-9-21(10-12-24)19-30-20-22-5-4-7-25(30)17-22/h2-3,6,8-12,22,25-26,29H,4-5,7,13-20H2,1H3
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| InChIKey |
QAPWXKPJZPOITM-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