In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 24 | 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) | 0.88 | 5.17 | -37.86 | 6 | 8 | 1 | 131 | 327.368 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 5.23 | -15.97 | 5 | 8 | 0 | 129 | 326.36 | 4 | ↓ |