In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2007 | 31 | 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) | 3.90 | -0.35 | -13.64 | 1 | 6 | 0 | 73 | 433.895 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.90 | -0.14 | -54.26 | 2 | 6 | 1 | 74 | 434.903 | 6 | ↓ |