General Information of the Compound
| Compound ID |
CP0515417
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| Compound Name |
2-[(5-chloro-1H-indol-3-yl)methyl]-1H-indole-3-carbaldehyde
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| Structure |
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| Formula |
C18H13ClN2O
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| Molecular Weight |
308.768
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| Canonical SMILES |
Clc1ccc2[nH]cc(Cc3[nH]c4ccccc4c3C=O)c2c1
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| InChI |
InChI=1S/C18H13ClN2O/c19-12-5-6-16-14(8-12)11(9-20-16)7-18-15(10-22)13-3-1-2-4-17(13)21-18/h1-6,8-10,20-21H,7H2
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| InChIKey |
IDDUUHHPSKLXPI-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