In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 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) | 0.89 | 7.46 | -187.19 | 0 | 7 | -3 | 137 | 333.316 | 11 | ↓ |
Lo Low (pH 4.5-6) | 0.89 | 6.34 | -107.75 | 1 | 7 | -2 | 135 | 334.324 | 11 | ↓ |