General Information of the Compound
| Compound ID |
CP0349430
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| Compound Name |
1-(4-methoxy-2,3-dimethylphenylsulfonyl)-N-(3-(4-methylpiperazin-1-yl)propyl)indoline-3-carboxamide
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| Structure |
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| Formula |
C26H36N4O4S
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| Molecular Weight |
500.665
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| Canonical SMILES |
COc1ccc(c(C)c1C)S(=O)(=O)N1CC(C(=O)NCCCN2CCN(C)CC2)c2ccccc12
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| InChI |
InChI=1S/C26H36N4O4S/c1-19-20(2)25(11-10-24(19)34-4)35(32,33)30-18-22(21-8-5-6-9-23(21)30)26(31)27-12-7-13-29-16-14-28(3)15-17-29/h5-6,8-11,22H,7,12-18H2,1-4H3,(H,27,31)
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| InChIKey |
NKYZPXWNGDIHCJ-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