In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2011 | 23 | 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) | 1.26 | 4.98 | -11.91 | 1 | 6 | 0 | 65 | 332.429 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 5.72 | -25.16 | 2 | 6 | 0 | 66 | 333.437 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.