General Information of the Compound
| Compound ID |
CP0123209
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| Compound Name |
2-(3,5-dimethylpyrazol-1-yl)-6-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine
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| Structure |
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| Formula |
C20H25N7O
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| Molecular Weight |
379.468
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| Canonical SMILES |
COC[C@H]1CCCN1c1cc(Nc2ccccn2)nc(n1)-n1nc(C)cc1C
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| InChI |
InChI=1S/C20H25N7O/c1-14-11-15(2)27(25-14)20-23-18(22-17-8-4-5-9-21-17)12-19(24-20)26-10-6-7-16(26)13-28-3/h4-5,8-9,11-12,16H,6-7,10,13H2,1-3H3,(H,21,22,23,24)/t16-/m1/s1
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| InChIKey |
CPTFLTJFGWOVRS-MRXNPFEDSA-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