In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 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) | 2.06 | 3.6 | -10.05 | 2 | 4 | 0 | 54 | 304.147 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.06 | 3.99 | -31.96 | 3 | 4 | 1 | 55 | 305.155 | 2 | ↓ |