In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 36 | 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) | 5.70 | 17.22 | -105.31 | 2 | 5 | 2 | 30 | 493.715 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.70 | 14.99 | -35.87 | 1 | 5 | 1 | 29 | 492.707 | 9 | ↓ |