In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2008 | 25 | 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) | 1.56 | 2.98 | -14.72 | 1 | 7 | 0 | 87 | 369.487 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.56 | 4.99 | -48.11 | 2 | 7 | 1 | 88 | 370.495 | 4 | ↓ |