In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | 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) | 3.77 | 8.17 | -43.18 | 2 | 3 | 1 | 29 | 268.384 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 8.52 | -79.67 | 3 | 3 | 2 | 31 | 269.392 | 2 | ↓ |