In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 16 | 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) | 1.63 | 4.05 | -47.66 | 4 | 3 | 1 | 60 | 241.742 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 2.79 | -9.44 | 3 | 3 | 0 | 55 | 240.734 | 6 | ↓ |