In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 19 | 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) | 3.86 | 7.73 | -31.2 | 2 | 3 | 1 | 35 | 266.405 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.86 | 6.97 | -3.86 | 1 | 3 | 0 | 30 | 265.397 | 10 | ↓ |