In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2008 | 26 | 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) | 5.96 | 7.77 | -43.8 | 0 | 5 | -1 | 70 | 382.852 | 1 | ↓ |
Ref Reference (pH 7) | 5.96 | 7.28 | -45.8 | 0 | 5 | -1 | 70 | 382.852 | 1 | ↓ |
Mid Mid (pH 6-8) | 5.51 | 9.38 | -8.92 | 1 | 5 | 0 | 67 | 383.86 | 1 | ↓ |
Mid Mid (pH 6-8) | 5.51 | 9.09 | -9.06 | 1 | 5 | 0 | 67 | 383.86 | 1 | ↓ |