In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 26th, 2007 | 31 | 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) | 1.93 | 6.02 | -61.11 | 0 | 8 | -1 | 97 | 424.429 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 5.14 | -27.18 | 1 | 8 | 0 | 95 | 425.437 | 6 | ↓ |