In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | 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) | 0.45 | 3.51 | -53.05 | 4 | 4 | 1 | 63 | 252.363 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 2.22 | -9.71 | 3 | 4 | 0 | 58 | 251.355 | 3 | ↓ |