In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 22 | 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) | 1.60 | 5.01 | -48.77 | 3 | 5 | 1 | 66 | 319.454 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 3.66 | -9.84 | 2 | 5 | 0 | 61 | 318.446 | 2 | ↓ |