General Information of the Compound
| Compound ID |
CP0221985
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| Compound Name |
6-(1H-pyrazol-4-yl)-N-(2-thiophen-2-ylethyl)-1H-indole-3-carboxamide
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| Structure |
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| Formula |
C18H16N4OS
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| Molecular Weight |
336.42
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| Canonical SMILES |
O=C(NCCc1cccs1)c1c[nH]c2cc(ccc12)-c1cn[nH]c1
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| InChI |
InChI=1S/C18H16N4OS/c23-18(19-6-5-14-2-1-7-24-14)16-11-20-17-8-12(3-4-15(16)17)13-9-21-22-10-13/h1-4,7-11,20H,5-6H2,(H,19,23)(H,21,22)
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| InChIKey |
CVJDWPOZUNTTIU-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