General Information of the Compound
| Compound ID |
CP0503442
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| Compound Name |
Butyl-[3-(2,4-dichloro-phenyl)-1,5-dimethyl-1H-pyrazolo[4,3-b]pyridin-7-yl]-pyridin-4-ylmethyl-amine
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| Structure |
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| Formula |
C24H25Cl2N5
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| Molecular Weight |
454.405
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| Canonical SMILES |
CCCCN(Cc1ccncc1)c1cc(C)nc2c(nn(C)c12)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C24H25Cl2N5/c1-4-5-12-31(15-17-8-10-27-11-9-17)21-13-16(2)28-23-22(29-30(3)24(21)23)19-7-6-18(25)14-20(19)26/h6-11,13-14H,4-5,12,15H2,1-3H3
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| InChIKey |
JLFCHKGQDFLSPP-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