In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2004 | 27 | 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) | 3.87 | -1.19 | -11.7 | 1 | 4 | 0 | 54 | 353.425 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.87 | -1.08 | -48.15 | 2 | 4 | 1 | 56 | 354.433 | 4 | ↓ |