In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2006 | 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) | 2.59 | 3.81 | -45.32 | 4 | 5 | 1 | 76 | 332.42 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 2.72 | -9.06 | 3 | 5 | 0 | 71 | 331.412 | 8 | ↓ |