In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 17 | 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) | 1.37 | 5.43 | -37.61 | 1 | 4 | 1 | 34 | 241.355 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 3.18 | -6.91 | 0 | 4 | 0 | 33 | 240.347 | 4 | ↓ |