In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 36 | 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) | 0.45 | 4.28 | -24.74 | 3 | 10 | 0 | 118 | 494.596 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 6.43 | -57.74 | 4 | 10 | 1 | 119 | 495.604 | 5 | ↓ |