In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2010 | 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) | 3.21 | 14.35 | -47.21 | 1 | 8 | 1 | 77 | 473.34 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.21 | 13.84 | -14.89 | 0 | 8 | 0 | 76 | 472.332 | 7 | ↓ |