In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2011 | 13 | 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) | -0.35 | -1.66 | -43.02 | 4 | 4 | 1 | 66 | 188.247 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.35 | -1.92 | -4.45 | 3 | 4 | 0 | 65 | 187.239 | 1 | ↓ |