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) | 4.27 | 13.03 | -56.04 | 1 | 6 | 1 | 62 | 524.732 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.27 | 11.41 | -18.52 | 0 | 6 | 0 | 61 | 523.724 | 7 | ↓ |