In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 20 | 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) | 4.51 | 8.93 | -6.91 | 2 | 2 | 0 | 39 | 284.359 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.51 | 8.99 | -35.72 | 1 | 2 | -1 | 36 | 283.351 | 3 | ↓ |