In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2010 | 15 | 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) | 1.84 | 6.56 | -35.02 | 3 | 3 | 1 | 34 | 206.313 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.84 | 6.36 | -103.72 | 4 | 3 | 2 | 35 | 207.321 | 2 | ↓ |