In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 29 | 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) | 1.40 | 5.31 | -46.48 | 2 | 8 | -1 | 127 | 408.463 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 7.09 | -11.37 | 3 | 8 | 0 | 124 | 409.471 | 6 | ↓ |