General Information of the Compound
| Compound ID |
CP0213910
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| Compound Name |
2-[2-(2,6-dichloroanilino)phenyl]-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]acetamide
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| Structure |
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| Formula |
C24H21Cl2N3O2
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| Molecular Weight |
454.357
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| Canonical SMILES |
Oc1ccc2[nH]cc(CCNC(=O)Cc3ccccc3Nc3c(Cl)cccc3Cl)c2c1
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| InChI |
InChI=1S/C24H21Cl2N3O2/c25-19-5-3-6-20(26)24(19)29-21-7-2-1-4-15(21)12-23(31)27-11-10-16-14-28-22-9-8-17(30)13-18(16)22/h1-9,13-14,28-30H,10-12H2,(H,27,31)
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| InChIKey |
SHOXQOLXDAMSBX-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