In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 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) | -0.12 | 1.69 | -40.28 | 3 | 4 | 1 | 57 | 201.29 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.12 | 0.25 | -10.31 | 2 | 4 | 0 | 53 | 200.282 | 4 | ↓ |