In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 18 | 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) | 3.85 | 7.61 | -1.77 | 2 | 2 | 0 | 29 | 250.361 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.85 | 7.71 | -33.04 | 3 | 2 | 1 | 30 | 251.369 | 3 | ↓ |