In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | 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) | -0.50 | 1.3 | -47.07 | 3 | 5 | 1 | 60 | 256.37 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.50 | 3.34 | -92.98 | 4 | 5 | 2 | 62 | 257.378 | 5 | ↓ |