In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 34 | 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) | 1.52 | 6.02 | -59.42 | 0 | 9 | -1 | 105 | 467.498 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 8.37 | -68.29 | 1 | 9 | 0 | 106 | 468.506 | 9 | ↓ |