In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 10 | 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) | -0.12 | 1.25 | -6.45 | 1 | 3 | 0 | 53 | 138.17 | 0 | ↓ |
Mid Mid (pH 6-8) | -0.12 | 2.52 | -48.99 | 2 | 3 | 1 | 57 | 139.178 | 0 | ↓ |