In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 13 | 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) | 0.41 | 1.07 | -6.2 | 1 | 3 | 0 | 42 | 210.18 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.59 | -1.08 | -36.8 | 0 | 3 | -1 | 48 | 209.172 | 3 | ↓ |