General Information of the Compound
| Compound ID |
CP0482129
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| Compound Name |
(3E)-3-[(4,6-dianilino-1,3,5-triazin-2-yl)hydrazinylidene]propane-1,2-diol
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| Structure |
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| Formula |
C18H19N7O2
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| Molecular Weight |
365.397
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| Canonical SMILES |
OCC(O)\C=N\Nc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
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| InChI |
InChI=1S/C18H19N7O2/c26-12-15(27)11-19-25-18-23-16(20-13-7-3-1-4-8-13)22-17(24-18)21-14-9-5-2-6-10-14/h1-11,15,26-27H,12H2,(H3,20,21,22,23,24,25)/b19-11+
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| InChIKey |
ZVIWROLUXGGDNS-YBFXNURJSA-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