General Information of the Compound
| Compound ID |
CP0879780
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| Compound Name |
endo-8-(Naphtho[1,2-b]fur-3-ylmethyl)-3-(4-chlorophenyl)-8-azabicyclo[3.2.1]octan-3-ol
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| Formula |
C26H24ClNO2
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| Molecular Weight |
417.936
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| Canonical SMILES |
O[C@@]1(c2ccc(Cl)cc2)C[C@H]2CC[C@@H](C1)N2Cc1coc2c1ccc1ccccc12
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| InChI |
InChI=1S/C26H24ClNO2/c27-20-8-6-19(7-9-20)26(29)13-21-10-11-22(14-26)28(21)15-18-16-30-25-23-4-2-1-3-17(23)5-12-24(18)25/h1-9,12,16,21-22,29H,10-11,13-15H2/t21-,22+,26+
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| InChIKey |
UNGWGGUPRUDQFM-PHTYHVAFSA-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
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor