General Information of the Compound
| Compound ID |
CP0522727
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| Compound Name |
2-[6-(3-chlorophenyl)-4-oxo-2-(4-piperidin-1-ylbutoxy)pyrazolo[1,5-a]pyrazin-5-yl]-N-propan-2-ylacetamide
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| Structure |
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| Formula |
C26H34ClN5O3
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| Molecular Weight |
500.043
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| Canonical SMILES |
CC(C)NC(=O)Cn1c(cn2nc(OCCCCN3CCCCC3)cc2c1=O)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C26H34ClN5O3/c1-19(2)28-24(33)18-31-23(20-9-8-10-21(27)15-20)17-32-22(26(31)34)16-25(29-32)35-14-7-6-13-30-11-4-3-5-12-30/h8-10,15-17,19H,3-7,11-14,18H2,1-2H3,(H,28,33)
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| InChIKey |
IEUCHEAUWJGKKD-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