In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2008 | 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) | 0.16 | 6.84 | -51.59 | 2 | 8 | -1 | 119 | 437.472 | 6 | ↓ |
Ref Reference (pH 7) | 0.16 | 6.37 | -56.05 | 2 | 8 | -1 | 119 | 437.472 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.16 | 7.42 | -35.45 | 3 | 8 | 0 | 124 | 438.48 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.16 | 7.95 | -31 | 3 | 8 | 0 | 124 | 438.48 | 6 | ↓ |