In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2007 | 36 | 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) | 1.63 | 0.43 | -54.59 | 2 | 10 | 1 | 112 | 501.556 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 0.38 | -63.67 | 1 | 10 | 1 | 108 | 501.556 | 10 | ↓ |