In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | 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) | 2.86 | 11.31 | -46.02 | 1 | 7 | 0 | 82 | 427.497 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 9.84 | -55.24 | 0 | 7 | -1 | 80 | 426.489 | 7 | ↓ |