In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 13th, 2006 | 14 | 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) | 1.57 | 5.77 | -41.96 | 1 | 3 | 1 | 25 | 199.318 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 3.64 | -6.54 | 0 | 3 | 0 | 24 | 198.31 | 1 | ↓ |