In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 14 | 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) | 1.90 | 5.97 | -40.36 | 2 | 2 | 1 | 29 | 189.282 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.90 | 4.69 | -5.59 | 1 | 2 | 0 | 25 | 188.274 | 4 | ↓ |