General Information of the Compound
| Compound ID |
CP0515646
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| Compound Name |
1-(2,4-Dimethyl-oxazole-5-sulfonyl)-3-(1,2,5,6-tetrahydro-pyridin-3-yl)-1H-indole
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| Structure |
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| Formula |
C18H19N3O3S
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| Molecular Weight |
357.435
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| Canonical SMILES |
Cc1nc(C)c(o1)S(=O)(=O)n1cc(C2=CCCNC2)c2ccccc12
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| InChI |
InChI=1S/C18H19N3O3S/c1-12-18(24-13(2)20-12)25(22,23)21-11-16(14-6-5-9-19-10-14)15-7-3-4-8-17(15)21/h3-4,6-8,11,19H,5,9-10H2,1-2H3
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| InChIKey |
AHMBKTMJOBDXMV-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