In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 26 | 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) | 0.31 | 4.95 | -60.55 | 3 | 7 | 1 | 84 | 362.498 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.31 | 5.09 | -102.54 | 4 | 7 | 2 | 85 | 363.506 | 5 | ↓ |