General Information of the Compound
| Compound ID |
CP0064497
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| Compound Name |
3-(benzo[b]thiophen-5-yl)-3-benzylpyrrolidine
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| Synonyms |
3-(benzo[b]thiophen-5-yl)-3-benzylpyrrolidine
BDBM50275440
CHEMBL486537
SCHEMBL984632
VVROCSNBKQTQEO-UHFFFAOYSA-N
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| Structure |
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| Formula |
C19H19NS
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| Molecular Weight |
293.435
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| Canonical SMILES |
C(c1ccccc1)C1(CCNC1)c1ccc2sccc2c1
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| InChI |
InChI=1S/C19H19NS/c1-2-4-15(5-3-1)13-19(9-10-20-14-19)17-6-7-18-16(12-17)8-11-21-18/h1-8,11-12,20H,9-10,13-14H2
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| InChIKey |
VVROCSNBKQTQEO-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
Clinical Information about the Compound