General Information of the Compound
| Compound ID |
CP0562491
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| Compound Name |
2-(4-chlorophenyl)-1-[(E)-(5-methoxy-7-methyl-1H-indol-3-yl)methylideneamino]guanidine
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| Structure |
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| Formula |
C18H18ClN5O
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| Molecular Weight |
355.829
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| Canonical SMILES |
COc1cc(C)c2[nH]cc(\C=N\NC(=N)Nc3ccc(Cl)cc3)c2c1
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| InChI |
InChI=1S/C18H18ClN5O/c1-11-7-15(25-2)8-16-12(9-21-17(11)16)10-22-24-18(20)23-14-5-3-13(19)4-6-14/h3-10,21H,1-2H3,(H3,20,23,24)/b22-10+
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| InChIKey |
QMJRSHRHMKXFHA-LSHDLFTRSA-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