General Information of the Compound
| Compound ID |
CP0534459
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| Compound Name |
Butyl-[3-(2,4-dichloro-phenyl)-1,5-dimethyl-1H-pyrazolo[4,3-b]pyridin-7-yl]-amine
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| Structure |
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| Formula |
C18H20Cl2N4
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| Molecular Weight |
363.292
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| Canonical SMILES |
CCCCNc1cc(C)nc2c(nn(C)c12)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C18H20Cl2N4/c1-4-5-8-21-15-9-11(2)22-17-16(23-24(3)18(15)17)13-7-6-12(19)10-14(13)20/h6-7,9-10H,4-5,8H2,1-3H3,(H,21,22)
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| InChIKey |
NVTBPKIUNYSQKF-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