General Information of the Compound
| Compound ID |
CP0917435
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| Compound Name |
rac-6-methoxy-9-(3-(trifluoromethyl)phenylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-3-amine hydrochloride
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| Structure |
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| Formula |
C20H20ClF3N2O3S
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| Molecular Weight |
460.905
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| Canonical SMILES |
COc1ccc2c(c1)c1c(n2S(=O)(=O)c2cccc(C(F)(F)F)c2)CCC(N)C1.Cl
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| InChI |
InChI=1S/C20H19F3N2O3S.ClH/c1-28-14-6-8-19-17(11-14)16-10-13(24)5-7-18(16)25(19)29(26,27)15-4-2-3-12(9-15)20(21,22)23;/h2-4,6,8-9,11,13H,5,7,10,24H2,1H3;1H
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| InChIKey |
ZFFSGABXGXSDLV-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