General Information of the Compound
| Compound ID |
CP0390615
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| Compound Name |
1-(3,4-dichlorobenzyl)-5-hydroxy-1H-indole-2-carboxylic acid
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| Structure |
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| Formula |
C16H11Cl2NO3
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| Molecular Weight |
336.174
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| Canonical SMILES |
OC(=O)c1cc2cc(O)ccc2n1Cc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C16H11Cl2NO3/c17-12-3-1-9(5-13(12)18)8-19-14-4-2-11(20)6-10(14)7-15(19)16(21)22/h1-7,20H,8H2,(H,21,22)
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| InChIKey |
BBRSCGBAIAKATH-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