In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 29 | No |
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) | 3.26 | 11.09 | -39 | 0 | 5 | -1 | 63 | 408.409 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.80 | 12.18 | -9.62 | 1 | 5 | 0 | 60 | 409.417 | 3 | ↓ |