In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2011 | 21 | No |
Popular Name: 2-[(5-tert-butyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl-propyl-amino]-N,N-dimethyl-acetamide 2-[(5-tert-butyl-2-thioxo-1,3,4-…
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) | 1.50 | 6 | -34.44 | 1 | 6 | 1 | 56 | 315.463 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 3.7 | -10.83 | 0 | 6 | 0 | 55 | 314.455 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.