General Information of the Compound
| Compound ID |
CP0407849
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| Compound Name |
3-(1H-indol-3-ylmethyl)-1H-indole-5-carboxylic acid
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| Structure |
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| Formula |
C18H14N2O2
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| Molecular Weight |
290.322
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| Canonical SMILES |
OC(=O)c1ccc2[nH]cc(Cc3c[nH]c4ccccc34)c2c1
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| InChI |
InChI=1S/C18H14N2O2/c21-18(22)11-5-6-17-15(8-11)13(10-20-17)7-12-9-19-16-4-2-1-3-14(12)16/h1-6,8-10,19-20H,7H2,(H,21,22)
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| InChIKey |
KQGNAGYBPHWHON-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