In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 38 | 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) | 6.10 | 17.99 | -37.48 | 1 | 7 | 0 | 91 | 528.734 | 17 | ↓ |
Mid Mid (pH 6-8) | 6.10 | 18.01 | -52.82 | 0 | 7 | -1 | 90 | 527.726 | 17 | ↓ |