In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 36 | 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) | -4.92 | 3.25 | -166.19 | 3 | 13 | -3 | 201 | 506.536 | 10 | ↓ |
Mid Mid (pH 6-8) | -4.92 | 5.94 | -131.04 | 4 | 13 | -2 | 202 | 507.544 | 10 | ↓ |