In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2009 | 24 | 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) | 3.34 | 7.56 | -7.78 | 0 | 4 | 0 | 31 | 327.424 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 9.82 | -39.06 | 1 | 4 | 1 | 32 | 328.432 | 7 | ↓ |