In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 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) | 1.97 | 7.84 | -73.82 | 1 | 7 | 0 | 87 | 384.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 8.02 | -47.87 | 2 | 7 | 1 | 84 | 385.44 | 7 | ↓ |