In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2008 | 20 | 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) | 3.18 | 6.9 | -8.82 | 1 | 3 | 0 | 32 | 268.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.18 | 9.08 | -36.9 | 2 | 3 | 1 | 34 | 269.368 | 4 | ↓ |