General Information of the Compound
| Compound ID |
CP0429950
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| Compound Name |
4-(5-Amino-2-furan-2-yl-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-ylmethyl)-phenol
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| Structure |
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| Formula |
C17H13N7O2
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| Molecular Weight |
347.338
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| Canonical SMILES |
Nc1nc2n(Cc3ccc(O)cc3)ncc2c2nc(nn12)-c1ccco1
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| InChI |
InChI=1S/C17H13N7O2/c18-17-21-15-12(8-19-23(15)9-10-3-5-11(25)6-4-10)16-20-14(22-24(16)17)13-2-1-7-26-13/h1-8,25H,9H2,(H2,18,21)
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| InChIKey |
NCUYJDMFUAXBHH-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