In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 21 | No |
None
None
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) | -1.51 | 3.44 | -40.56 | 2 | 7 | 1 | 74 | 299.395 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.51 | 1.36 | -18.59 | 1 | 7 | 0 | 73 | 298.387 | 5 | ↓ |