General Information of the Compound
| Compound ID |
CP0386364
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| Compound Name |
1-(benzenesulfonyl)-3-(1,2,3,6-tetrahydropyridin-4-yl)pyrrolo[2,3-f]quinoline
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| Structure |
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| Formula |
C22H19N3O2S
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| Molecular Weight |
389.48
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| Canonical SMILES |
O=S(=O)(c1ccccc1)n1cc(C2=CCNCC2)c2ccc3ncccc3c12
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| InChI |
InChI=1S/C22H19N3O2S/c26-28(27,17-5-2-1-3-6-17)25-15-20(16-10-13-23-14-11-16)18-8-9-21-19(22(18)25)7-4-12-24-21/h1-10,12,15,23H,11,13-14H2
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| InChIKey |
JXPCOWBALWVGCA-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