In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2009 | 16 | 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) | -0.14 | 3.93 | -70.02 | 2 | 5 | 0 | 74 | 226.276 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.14 | 2.81 | -43.62 | 3 | 5 | 1 | 71 | 227.284 | 4 | ↓ |