General Information of the Compound
| Compound ID |
CP0541656
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| Compound Name |
6-Furan-2-yl-9-(3-phenyl-propyl)-9H-purin-2-ylamine
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| Structure |
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| Formula |
C18H17N5O
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| Molecular Weight |
319.368
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| Canonical SMILES |
Nc1nc(-c2ccco2)c2ncn(CCCc3ccccc3)c2n1
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| InChI |
InChI=1S/C18H17N5O/c19-18-21-15(14-9-5-11-24-14)16-17(22-18)23(12-20-16)10-4-8-13-6-2-1-3-7-13/h1-3,5-7,9,11-12H,4,8,10H2,(H2,19,21,22)
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| InChIKey |
KUBCULDZDHDDSR-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