General Information of the Compound
| Compound ID |
CP0677749
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| Compound Name |
N2-((4-Chloro-1H-benzo[d]imidazol-5-yl)methyl)-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-methylpyrimidine-2,4-diamine
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| Structure |
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| Formula |
C19H19ClN8
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| Molecular Weight |
394.87
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| Canonical SMILES |
CN(Cc1ccc2[nH]cnc2c1Cl)c1nccc(Nc2cc(C3CC3)[nH]n2)n1
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| InChI |
InChI=1S/C19H19ClN8/c1-28(9-12-4-5-13-18(17(12)20)23-10-22-13)19-21-7-6-15(25-19)24-16-8-14(26-27-16)11-2-3-11/h4-8,10-11H,2-3,9H2,1H3,(H,22,23)(H2,21,24,25,26,27)
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| InChIKey |
LDWBULFGVRAVMR-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