General Information of the Compound
| Compound ID |
CP0410804
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| Compound Name |
5-cyclopropyl-3-[[1-(4-methylpyrimidin-2-yl)piperidin-3-yl]methyl]triazolo[4,5-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C18H23N9
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| Molecular Weight |
365.445
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| Canonical SMILES |
Cc1ccnc(n1)N1CCCC(Cn2nnc3c(N)nc(nc23)C2CC2)C1
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| InChI |
InChI=1S/C18H23N9/c1-11-6-7-20-18(21-11)26-8-2-3-12(9-26)10-27-17-14(24-25-27)15(19)22-16(23-17)13-4-5-13/h6-7,12-13H,2-5,8-10H2,1H3,(H2,19,22,23)
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| InChIKey |
BVPVUJZHLZKGNW-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