In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2006 | 25 | 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) | 4.09 | 6.21 | -17.26 | 2 | 5 | 0 | 75 | 377.466 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.55 | 4.97 | -44.26 | 1 | 5 | -1 | 78 | 376.458 | 6 | ↓ |