General Information of the Compound
| Compound ID |
CP0908362
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| Compound Name |
endo-8-(1H-Indol-3-ylmethyl)-3-(2-methoxyphenyl)-8-azabicyclo[3.2.1]octan-3-ol
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| Formula |
C23H26N2O2
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| Molecular Weight |
362.473
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| Canonical SMILES |
COc1ccccc1[C@]1(O)C[C@H]2CC[C@@H](C1)N2Cc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C23H26N2O2/c1-27-22-9-5-3-7-20(22)23(26)12-17-10-11-18(13-23)25(17)15-16-14-24-21-8-4-2-6-19(16)21/h2-9,14,17-18,24,26H,10-13,15H2,1H3/t17-,18+,23+
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| InChIKey |
JPSSDJSKUUWHMS-CYGODWOOSA-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