In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 21 | Yes |
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) | 0.17 | 2.37 | -56.95 | 2 | 8 | 0 | 113 | 296.327 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.17 | -0.04 | -53.25 | 1 | 8 | -1 | 111 | 295.319 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.