In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 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) | 3.96 | 9.74 | -11.99 | 2 | 5 | 0 | 71 | 308.385 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.96 | 10.28 | -42.34 | 3 | 5 | 1 | 72 | 309.393 | 5 | ↓ |