In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 32 | No |
None
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) | 2.79 | 6.05 | -17.96 | 2 | 7 | 0 | 96 | 437.492 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.20 | 6.74 | -24.73 | 1 | 7 | 0 | 93 | 437.492 | 11 | ↓ |