General Information of the Compound
| Compound ID |
CP0411968
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| Compound Name |
4-(4-methylpiperazin-1-yl)-6-[(E)-2-naphthalen-2-ylethenyl]-1,3,5-triazin-2-amine
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| Structure |
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| Formula |
C20H22N6
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| Molecular Weight |
346.438
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| Canonical SMILES |
CN1CCN(CC1)c1nc(N)nc(\C=C\c2ccc3ccccc3c2)n1
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| InChI |
InChI=1S/C20H22N6/c1-25-10-12-26(13-11-25)20-23-18(22-19(21)24-20)9-7-15-6-8-16-4-2-3-5-17(16)14-15/h2-9,14H,10-13H2,1H3,(H2,21,22,23,24)/b9-7+
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| InChIKey |
ISAFWNVCSUGFJE-VQHVLOKHSA-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