In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 28 | 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) | 2.76 | 9.89 | -17.04 | 1 | 8 | 0 | 91 | 383.452 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 10.18 | -36.94 | 2 | 8 | 1 | 96 | 384.46 | 5 | ↓ |