In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 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) | 1.51 | 6.1 | -56.24 | 4 | 3 | 1 | 57 | 299.419 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 5.69 | -9.89 | 3 | 3 | 0 | 55 | 298.411 | 3 | ↓ |