General Information of the Compound
| Compound ID |
CP0504631
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| Compound Name |
N-cyclopentyl-N'-[3-(2,6-dichlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
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| Structure |
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| Formula |
C21H25Cl2N5
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| Molecular Weight |
418.372
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| Canonical SMILES |
Cc1nn2c(NCCNC3CCCC3)cc(C)nc2c1-c1c(Cl)cccc1Cl
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| InChI |
InChI=1S/C21H25Cl2N5/c1-13-12-18(25-11-10-24-15-6-3-4-7-15)28-21(26-13)19(14(2)27-28)20-16(22)8-5-9-17(20)23/h5,8-9,12,15,24-25H,3-4,6-7,10-11H2,1-2H3
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| InChIKey |
QWBDMPTVXYWNBF-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