In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2007 | 34 | 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) | 2.15 | 0.5 | -55.36 | 2 | 10 | 1 | 126 | 468.486 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 0.39 | -65.89 | 1 | 10 | 1 | 123 | 468.486 | 8 | ↓ |