In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2006 | 27 | 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) | 3.10 | 6.9 | -55.53 | 0 | 6 | -1 | 79 | 386.811 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.54 | -0.25 | -20.04 | 1 | 6 | 0 | 76 | 387.819 | 4 | ↓ |