In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 23 | 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) | 3.02 | -1.03 | -48.19 | 1 | 3 | 1 | 30 | 324.473 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.02 | -0.92 | -98.58 | 2 | 3 | 2 | 31 | 325.481 | 4 | ↓ |