In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 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) | 4.70 | 12 | -9.34 | 0 | 2 | 0 | 18 | 341.252 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.70 | 12.44 | -31.59 | 1 | 2 | 1 | 19 | 342.26 | 5 | ↓ |