General Information of the Compound
| Compound ID |
CP0057497
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| Compound Name |
(3-Chloro-phenyl)-(5-methyl-6-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-amine
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| Structure |
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| Formula |
C19H15ClN4
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| Molecular Weight |
334.81
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| Canonical SMILES |
Cc1c([nH]c2ncnc(Nc3cccc(Cl)c3)c12)-c1ccccc1
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| InChI |
InChI=1S/C19H15ClN4/c1-12-16-18(23-15-9-5-8-14(20)10-15)21-11-22-19(16)24-17(12)13-6-3-2-4-7-13/h2-11H,1H3,(H2,21,22,23,24)
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| InChIKey |
SUHVLNRNLVTOCF-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