In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 2nd, 2006 | 37 | 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) | 1.09 | 7.13 | -25.51 | 1 | 10 | 0 | 108 | 507.543 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.09 | 7.64 | -62.74 | 2 | 10 | 1 | 110 | 508.551 | 8 | ↓ |