In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 37 | 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) | 3.62 | 13.87 | -60.24 | 1 | 7 | 1 | 64 | 518.659 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 12.09 | -17.96 | 0 | 7 | 0 | 62 | 517.651 | 5 | ↓ |