General Information of the Compound
| Compound ID |
CP0431467
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| Compound Name |
C-(9-Benzyl-6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-4-yl)-methylamine
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| Structure |
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| Formula |
C21H24N2O
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| Molecular Weight |
320.436
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| Canonical SMILES |
COc1ccc2n(Cc3ccccc3)c3CCCC(CN)c3c2c1
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| InChI |
InChI=1S/C21H24N2O/c1-24-17-10-11-19-18(12-17)21-16(13-22)8-5-9-20(21)23(19)14-15-6-3-2-4-7-15/h2-4,6-7,10-12,16H,5,8-9,13-14,22H2,1H3
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| InChIKey |
PFWVDEMGTZCRQF-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