General Information of the Compound
| Compound ID |
CP0402525
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| Compound Name |
N'-[3-(2,4-dichlorophenyl)-2,5-dimethylpyrazolo[4,3-d]pyrimidin-7-yl]-N,N-dimethyl-N'-propylethane-1,2-diamine
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| Structure |
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| Formula |
C20H26Cl2N6
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| Molecular Weight |
421.376
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| Canonical SMILES |
CCCN(CCN(C)C)c1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12
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| InChI |
InChI=1S/C20H26Cl2N6/c1-6-9-28(11-10-26(3)4)20-18-17(23-13(2)24-20)19(27(5)25-18)15-8-7-14(21)12-16(15)22/h7-8,12H,6,9-11H2,1-5H3
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| InChIKey |
WEQSXWDPPMOIEJ-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