In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | 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) | 3.36 | 9.93 | -11.2 | 0 | 3 | 0 | 30 | 271.323 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 10.69 | -28.25 | 1 | 3 | 1 | 31 | 272.331 | 2 | ↓ |