In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2010 | 11 | 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) | 0.02 | 5.24 | -120.88 | 0 | 4 | -2 | 80 | 156.137 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.02 | 3.6 | -43.29 | 1 | 4 | -1 | 77 | 157.145 | 2 | ↓ |