General Information of the Compound
| Compound ID |
CP0449134
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| Compound Name |
Butyl-[3-(2,4-dichloro-phenyl)-1,5-dimethyl-1H-pyrazolo[4,3-b]pyridin-7-yl]-(3-methoxy-propyl)-amine
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| Structure |
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| Formula |
C22H28Cl2N4O
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| Molecular Weight |
435.399
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| Canonical SMILES |
CCCCN(CCCOC)c1cc(C)nc2c(nn(C)c12)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C22H28Cl2N4O/c1-5-6-10-28(11-7-12-29-4)19-13-15(2)25-21-20(26-27(3)22(19)21)17-9-8-16(23)14-18(17)24/h8-9,13-14H,5-7,10-12H2,1-4H3
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| InChIKey |
VEYVCKVDJGSYIN-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