In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 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) | 2.03 | 6.73 | -56.3 | 0 | 6 | -1 | 79 | 368.34 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 5.99 | -14.66 | 1 | 6 | 0 | 76 | 369.348 | 3 | ↓ |