In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 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) | 5.27 | 13.02 | -51.42 | 0 | 6 | -1 | 62 | 450.371 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.55 | 13.18 | -17.47 | 1 | 6 | 0 | 64 | 451.379 | 8 | ↓ |