In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 12th, 2008 | 25 | 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) | 1.94 | 6.79 | -43.25 | 3 | 7 | 1 | 94 | 345.423 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 6.27 | -15.33 | 2 | 7 | 0 | 93 | 344.415 | 5 | ↓ |