In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 32 | 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) | 2.92 | 10.42 | -77.74 | 1 | 7 | 0 | 77 | 437.54 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 9.66 | -54.31 | 2 | 7 | 1 | 75 | 438.548 | 9 | ↓ |