In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 16 | 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) | 0.68 | 2.51 | -47.51 | 3 | 4 | 1 | 47 | 241.746 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 4.73 | -124.29 | 4 | 4 | 2 | 48 | 242.754 | 3 | ↓ |