In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 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) | 3.41 | 9.15 | -62.25 | 0 | 5 | -1 | 70 | 380.464 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.41 | 8.39 | -11.31 | 1 | 5 | 0 | 67 | 381.472 | 5 | ↓ |