General Information of the Compound
| Compound ID |
CP0373691
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| Compound Name |
Butyl-[2,5-dimethyl-3-(2,4,6-trichloro-phenyl)-pyrazolo[1,5-a]pyrimidin-7-yl]-ethyl-amine
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| Structure |
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| Formula |
C20H23Cl3N4
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| Molecular Weight |
425.791
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| Canonical SMILES |
CCCCN(CC)c1cc(C)nc2c(c(C)nn12)-c1c(Cl)cc(Cl)cc1Cl
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| InChI |
InChI=1S/C20H23Cl3N4/c1-5-7-8-26(6-2)17-9-12(3)24-20-18(13(4)25-27(17)20)19-15(22)10-14(21)11-16(19)23/h9-11H,5-8H2,1-4H3
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| InChIKey |
WQUDKLNARYWYOA-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