In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2011 | 18 | No |
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) | 3.62 | 11.55 | -100.53 | 3 | 3 | 2 | 36 | 251.418 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 10.4 | -38.81 | 2 | 3 | 1 | 34 | 250.41 | 8 | ↓ |