In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 25 | 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) | 0.15 | 1.53 | -42.62 | 3 | 6 | 1 | 82 | 351.377 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.15 | 0.05 | -15.41 | 2 | 6 | 0 | 77 | 350.369 | 6 | ↓ |