In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 21 | 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) | 4.26 | -0.72 | -11.77 | 1 | 3 | 0 | 41 | 317.175 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.26 | -0.63 | -40.56 | 2 | 3 | 1 | 43 | 318.183 | 2 | ↓ |