General Information of the Compound
| Compound ID |
CP0755021
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| Compound Name |
N-(3-(4-oxo-4H-chromene-3-carboxamido)propyl)-1-(phenylsulfonyl)-1H-indole-3-carboxamide
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| Structure |
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| Formula |
C28H23N3O6S
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| Molecular Weight |
529.574
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| Canonical SMILES |
O=C(NCCCNC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12)c1coc2ccccc2c1=O
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| InChI |
InChI=1S/C28H23N3O6S/c32-26-21-12-5-7-14-25(21)37-18-23(26)28(34)30-16-8-15-29-27(33)22-17-31(24-13-6-4-11-20(22)24)38(35,36)19-9-2-1-3-10-19/h1-7,9-14,17-18H,8,15-16H2,(H,29,33)(H,30,34)
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| InChIKey |
ABJPGJSDWYYXJI-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