In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 17 | Yes |
Popular Name: 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(3-methyl-2-thienyl)methyl]ethanamine 2-(1,1-dioxo-1,2-thiazolidin-2-y…
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 | 3.27 | -47.9 | 2 | 4 | 1 | 54 | 275.419 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 1.91 | -12.97 | 1 | 4 | 0 | 49 | 274.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.