In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 18 | 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) | 1.34 | 3.06 | -9.38 | 0 | 4 | 0 | 41 | 288.438 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 5.05 | -51.08 | 1 | 4 | 1 | 42 | 289.446 | 4 | ↓ |