General Information of the Compound
| Compound ID |
CP0245759
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| Compound Name |
(1R,2S,3R)-3-(6-amino-2-fluoropurin-9-yl)cyclopentane-1,2-diol
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| Structure |
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| Formula |
C10H12FN5O2
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| Molecular Weight |
253.237
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| Canonical SMILES |
Nc1nc(F)nc2n(cnc12)[C@@H]1CC[C@@H](O)[C@H]1O
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| InChI |
InChI=1S/C10H12FN5O2/c11-10-14-8(12)6-9(15-10)16(3-13-6)4-1-2-5(17)7(4)18/h3-5,7,17-18H,1-2H2,(H2,12,14,15)/t4-,5-,7+/m1/s1
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| InChIKey |
QDPMZSDKPBCVSY-XAHCXIQSSA-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