In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 38 | 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) | 4.13 | 14.15 | -53.5 | 1 | 7 | 1 | 64 | 532.686 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.13 | 12.38 | -15.87 | 0 | 7 | 0 | 62 | 531.678 | 5 | ↓ |