General Information of the Compound
| Compound ID |
CP0500522
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| Compound Name |
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 |
C23H20N2O2S
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| Molecular Weight |
388.492
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| Canonical SMILES |
O=S(=O)(c1ccc2ccccc2c1)n1cc(C2=CCNCC2)c2ccccc12
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| InChI |
InChI=1S/C23H20N2O2S/c26-28(27,20-10-9-17-5-1-2-6-19(17)15-20)25-16-22(18-11-13-24-14-12-18)21-7-3-4-8-23(21)25/h1-11,15-16,24H,12-14H2
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| InChIKey |
HNMNAGYJPITMSM-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