In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 29 | 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) | 5.31 | 12.28 | -17.09 | 1 | 8 | 0 | 120 | 386.367 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.31 | 0.67 | -59.8 | 2 | 8 | 1 | 121 | 387.375 | 5 | ↓ |