In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2005 | 32 | 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) | 5.07 | 0.07 | -11.99 | 0 | 6 | 0 | 74 | 433.504 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.07 | 0.22 | -14.87 | 0 | 6 | 0 | 74 | 433.504 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.25 | 1.23 | -12.39 | 0 | 6 | 0 | 74 | 433.504 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.25 | 0.16 | -12.7 | 0 | 6 | 0 | 74 | 433.504 | 8 | ↓ |