In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 20 | 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) | -0.45 | -0.91 | -48.32 | 6 | 6 | 1 | 103 | 277.348 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.45 | 1.27 | -106.95 | 7 | 6 | 2 | 104 | 278.356 | 4 | ↓ |