In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2011 | 25 | Yes |
Popular Name: 1-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-fluoro-phenyl]-3-(3-pyridylmethyl)urea 1-[5-(1,1-dioxo-1,2-thiazolidin-…
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) | 1.31 | 2.7 | -19.02 | 2 | 7 | 0 | 91 | 364.402 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.31 | 3.17 | -52.91 | 3 | 7 | 1 | 93 | 365.41 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.