In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2011 | 32 | 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) | 5.34 | 8.02 | -13.21 | 1 | 6 | 0 | 84 | 476.664 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.34 | 8.2 | -50.43 | 0 | 6 | -1 | 86 | 475.656 | 6 | ↓ |