General Information of the Compound
| Compound ID |
CP0562092
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| Compound Name |
[4-[[4-(3-chlorophenyl)-6-ethyl-1,3,5-triazin-2-yl]amino]phenyl]methanol
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| Structure |
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| Formula |
C18H17ClN4O
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| Molecular Weight |
340.814
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| Canonical SMILES |
CCc1nc(Nc2ccc(CO)cc2)nc(n1)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C18H17ClN4O/c1-2-16-21-17(13-4-3-5-14(19)10-13)23-18(22-16)20-15-8-6-12(11-24)7-9-15/h3-10,24H,2,11H2,1H3,(H,20,21,22,23)
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| InChIKey |
WBFIKIWRZNWWTE-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