In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2005 | 28 | 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) | 1.94 | 3.74 | -62.18 | 1 | 7 | -1 | 99 | 382.392 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.39 | -1.47 | -22.82 | 2 | 7 | 0 | 96 | 383.4 | 6 | ↓ |