In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2009 | 19 | No |
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) | 1.84 | 6.1 | -39.63 | 2 | 4 | 1 | 56 | 255.297 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.84 | 4.62 | -11.75 | 1 | 4 | 0 | 51 | 254.289 | 3 | ↓ |