General Information of the Compound
| Compound ID |
CP0505840
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| Compound Name |
5-N-(2-chloro-4-methoxyphenyl)-7-N-pentan-3-ylpyrazolo[1,5-a]pyrimidine-5,7-diamine
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| Structure |
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| Formula |
C18H22ClN5O
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| Molecular Weight |
359.861
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| Canonical SMILES |
CCC(CC)Nc1cc(Nc2ccc(OC)cc2Cl)nc2ccnn12
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| InChI |
InChI=1S/C18H22ClN5O/c1-4-12(5-2)21-18-11-16(23-17-8-9-20-24(17)18)22-15-7-6-13(25-3)10-14(15)19/h6-12,21H,4-5H2,1-3H3,(H,22,23)
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| InChIKey |
LHRKSJNQWAPZEB-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