In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2008 | 33 | No |
None
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) | -2.06 | -3.45 | -366.3 | 4 | 18 | -4 | 290 | 549.244 | 9 | ↓ |
Mid Mid (pH 6-8) | -2.06 | -4.61 | -229.17 | 5 | 18 | -3 | 288 | 550.252 | 9 | ↓ |