In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 25 | 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) | 1.44 | 8.91 | -10.6 | 0 | 6 | 0 | 62 | 337.427 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.44 | 9.26 | -40 | 1 | 6 | 1 | 63 | 338.435 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.