In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 2nd, 2008 | 22 | Yes |
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) | 1.02 | 5.78 | -39.05 | 2 | 6 | -1 | 93 | 318.378 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 5.73 | -15.41 | 3 | 6 | 0 | 95 | 319.386 | 5 | ↓ |