In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 14 | 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) | 1.08 | 1.54 | -35.5 | 3 | 4 | 1 | 54 | 203.306 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.08 | -0.43 | -8.96 | 2 | 4 | 0 | 53 | 202.298 | 8 | ↓ |