In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 36 | 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) | 3.44 | 9.99 | -70.78 | 1 | 8 | 0 | 93 | 490.556 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.44 | 9.26 | -47.8 | 2 | 8 | 1 | 90 | 491.564 | 9 | ↓ |