In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 24 | 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) | 6.06 | 12.32 | -11.25 | 0 | 3 | 0 | 27 | 322.452 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.06 | 12.72 | -25.43 | 1 | 3 | 1 | 28 | 323.46 | 8 | ↓ |