General Information of the Compound
| Compound ID |
CP0436439
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| Compound Name |
5-Methoxy-1-(naphthalene-2-sulfonyl)-3-(1,2,3,6-tetrahydro-pyridin-4-yl)-1H-indole
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| Structure |
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| Formula |
C24H22N2O3S
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| Molecular Weight |
418.518
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| Canonical SMILES |
COc1ccc2n(cc(C3=CCNCC3)c2c1)S(=O)(=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C24H22N2O3S/c1-29-20-7-9-24-22(15-20)23(18-10-12-25-13-11-18)16-26(24)30(27,28)21-8-6-17-4-2-3-5-19(17)14-21/h2-10,14-16,25H,11-13H2,1H3
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| InChIKey |
XJFRLONNOVLEKR-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