General Information of the Compound
| Compound ID |
CP0255142
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| Compound Name |
9-Benzyl-6-furan-2-yl-9H-purin-2-ylamine
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| Synonyms |
2-amino-6-furyl-9-benzyl purine
9-benzyl-6-(furan-2-yl)-9H-purin-2-amine
BDBM50165066
CHEMBL196436
SCHEMBL3268454
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| Structure |
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| Formula |
C16H13N5O
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| Molecular Weight |
291.314
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| Canonical SMILES |
Nc1nc(-c2ccco2)c2ncn(Cc3ccccc3)c2n1
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| InChI |
InChI=1S/C16H13N5O/c17-16-19-13(12-7-4-8-22-12)14-15(20-16)21(10-18-14)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,17,19,20)
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| InChIKey |
FZKKCBUDFSOYPA-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
Clinical Information about the Compound