In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 28 | No |
None
None
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) | 4.84 | 11.63 | -41.42 | 2 | 4 | 1 | 55 | 376.476 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.84 | 12.21 | -27.72 | 1 | 4 | 0 | 58 | 375.468 | 4 | ↓ |