In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2008 | 18 | 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) | 1.70 | 0.69 | -58.09 | 2 | 3 | -1 | 64 | 251.346 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 0.13 | -7.15 | 3 | 3 | 0 | 61 | 252.354 | 1 | ↓ |