In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 33 | Yes |
Popular Name: (1S,2R,3S,5S)-5-(6-aminopurin-9-yl)-3-benzyloxy-2-(benzyloxymethyl)cyclopentanol (1S,2R,3S,5S)-5-(6-aminopurin-9-…
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.29 | 9.78 | -14.07 | 3 | 8 | 0 | 108 | 445.523 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 10.25 | -39.29 | 4 | 8 | 1 | 110 | 446.531 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5340816 | IBM Patent Data |