In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2010 | 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) | 3.47 | 7.66 | -18.93 | 2 | 5 | 0 | 62 | 364.474 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.47 | 8.56 | -40.13 | 3 | 5 | 1 | 64 | 365.482 | 4 | ↓ |