General Information of the Compound
| Compound ID |
CP0574405
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| Compound Name |
ethyl 2-(phenylcarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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| Structure |
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| Formula |
C17H18N2O3S
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| Molecular Weight |
330.409
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| Canonical SMILES |
CCOC(=O)c1c(NC(=O)Nc2ccccc2)sc2CCCc12
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| InChI |
InChI=1S/C17H18N2O3S/c1-2-22-16(20)14-12-9-6-10-13(12)23-15(14)19-17(21)18-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3,(H2,18,19,21)
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| InChIKey |
CVDPSFUGGTXNPG-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