In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 21 | 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) | 2.83 | 9.26 | -46.58 | 2 | 3 | 1 | 34 | 283.395 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 6.94 | -9.17 | 1 | 3 | 0 | 32 | 282.387 | 7 | ↓ |