In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 32 | 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) | -1.26 | 0.73 | -140.24 | 3 | 12 | -2 | 181 | 482.308 | 9 | ↓ |
Mid Mid (pH 6-8) | -1.26 | -0.42 | -52.59 | 4 | 12 | -1 | 178 | 483.316 | 9 | ↓ |