In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2007 | 32 | 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) | 4.40 | 10.61 | -45.16 | 2 | 6 | 1 | 71 | 478.396 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 11.4 | -52.37 | 1 | 6 | 1 | 68 | 478.396 | 8 | ↓ |