In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 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) | 2.80 | 5.53 | -10.86 | 2 | 6 | 0 | 110 | 359.433 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.80 | 5.36 | -50.9 | 3 | 6 | 1 | 111 | 360.441 | 3 | ↓ |