In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 16 | 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) | 3.63 | 1.4 | -9.42 | 0 | 2 | 0 | 17 | 228.682 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.11 | 1.64 | -28.91 | 1 | 2 | 1 | 19 | 229.69 | 1 | ↓ |