General Information of the Compound
| Compound ID |
CP0430530
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| Compound Name |
4-N-(4-chlorophenyl)-6-(2,5-dichlorophenyl)pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C16H11Cl3N4
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| Molecular Weight |
365.651
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| Canonical SMILES |
Nc1nc(Nc2ccc(Cl)cc2)cc(n1)-c1cc(Cl)ccc1Cl
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| InChI |
InChI=1S/C16H11Cl3N4/c17-9-1-4-11(5-2-9)21-15-8-14(22-16(20)23-15)12-7-10(18)3-6-13(12)19/h1-8H,(H3,20,21,22,23)
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| InChIKey |
MWQCKNWBCFBOGD-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