In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 33 | 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) | 1.09 | 3.78 | -19.3 | 3 | 10 | 0 | 131 | 490.611 | 10 | ↓ |
Lo Low (pH 4.5-6) | 1.09 | 4.92 | -40.55 | 4 | 10 | 1 | 132 | 491.619 | 10 | ↓ |