In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2011 | 18 | 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) | 2.38 | 3.31 | -8.95 | 1 | 4 | 0 | 44 | 256.39 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.38 | 5.61 | -41.61 | 2 | 4 | 1 | 45 | 257.398 | 8 | ↓ |