In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 30 | Yes |
Popular Name: (1S,2S,4S,5S,7S,8S)-2,5,8-triphenylcyclononane-1,4,7-triol (1S,2S,4S,5S,7S,8S)-2,5,8-triphe…
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) | 5.25 | 10.67 | -4.85 | 3 | 3 | 0 | 61 | 402.534 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.