In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | No |
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) | 2.30 | 4.73 | -12.36 | 3 | 4 | 0 | 62 | 305.447 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 5.15 | -32.01 | 4 | 4 | 1 | 64 | 306.455 | 4 | ↓ |