In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2006 | 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) | 3.21 | 10.84 | -39.15 | 1 | 3 | 1 | 25 | 295.406 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 8.36 | -7.51 | 0 | 3 | 0 | 24 | 294.398 | 4 | ↓ |