In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2010 | 20 | Yes |
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) | 3.09 | 8.9 | -7 | 0 | 4 | 0 | 32 | 309.2 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.09 | 9.36 | -33.75 | 1 | 4 | 1 | 34 | 310.208 | 2 | ↓ |