General Information of the Compound
| Compound ID |
CP0867895
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| Compound Name |
endo-2-(8-(bis(2-chlorophenyl)methyl)-3-(4-hydroxybenzyl)-8-azabicyclo[3.2.1]octan-3-yl)acetamide
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| Formula |
C29H30Cl2N2O2
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| Molecular Weight |
509.477
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| Canonical SMILES |
NC(=O)C[C@]1(Cc2ccc(O)cc2)C[C@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl
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| InChI |
InChI=1S/C29H30Cl2N2O2/c30-25-7-3-1-5-23(25)28(24-6-2-4-8-26(24)31)33-20-11-12-21(33)17-29(16-20,18-27(32)35)15-19-9-13-22(34)14-10-19/h1-10,13-14,20-21,28,34H,11-12,15-18H2,(H2,32,35)/t20-,21+,29-
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| InChIKey |
UYDBENOANLFGKT-VPIZKCOQSA-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