In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 27 | 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) | 4.00 | 7.76 | -47.61 | 2 | 4 | -1 | 81 | 377.545 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.00 | 5.79 | -8.24 | 3 | 4 | 0 | 78 | 378.553 | 4 | ↓ |