In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 16 | No |
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) | 3.57 | 7.01 | -8.58 | 0 | 3 | 0 | 33 | 257.12 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 4.74 | -6.09 | 1 | 3 | 0 | 38 | 257.12 | 2 | ↓ |