In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 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) | 2.36 | 3.34 | -42.48 | 3 | 3 | 1 | 40 | 237.367 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 4.42 | -38.28 | 3 | 3 | 1 | 37 | 237.367 | 7 | ↓ |