In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 27 | Yes |
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) | 3.54 | 5.74 | -76.65 | 6 | 5 | 2 | 74 | 382.637 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 6.92 | -159.71 | 7 | 5 | 3 | 79 | 383.645 | 5 | ↓ |