In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2007 | 35 | 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) | 3.79 | 12.89 | -75.32 | 1 | 9 | 0 | 120 | 481.549 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 2.42 | -53.14 | 1 | 9 | 1 | 113 | 482.557 | 10 | ↓ |