General Information of the Compound
| Compound ID |
CP0389673
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| Compound Name |
3-(6-cyano-1,2,3,4-tetrahydrocarbazol-9-yl)-N,N-dimethylpropane-1-sulfonamide
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| Structure |
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| Formula |
C18H23N3O2S
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| Molecular Weight |
345.468
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| Canonical SMILES |
CN(C)S(=O)(=O)CCCn1c2CCCCc2c2cc(ccc12)C#N
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| InChI |
InChI=1S/C18H23N3O2S/c1-20(2)24(22,23)11-5-10-21-17-7-4-3-6-15(17)16-12-14(13-19)8-9-18(16)21/h8-9,12H,3-7,10-11H2,1-2H3
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| InChIKey |
TYOUBEAPKZQVRT-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