In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2006 | 23 | 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) | 1.84 | 7.03 | -42.6 | 0 | 7 | -1 | 85 | 333.393 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 7.18 | -14.5 | 1 | 7 | 0 | 82 | 334.401 | 6 | ↓ |