In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2007 | 37 | 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) | 4.25 | 11.74 | -83.92 | 2 | 7 | 0 | 94 | 500.595 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.67 | -0.23 | -47.31 | 2 | 7 | 1 | 88 | 501.603 | 10 | ↓ |