In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 23 | Yes |
Popular Name: 2-(3,4-dimethoxyphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-propanamide 2-(3,4-dimethoxyphenyl)-N-(5-eth…
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) | 2.54 | 6.25 | -20.61 | 1 | 6 | 0 | 73 | 335.429 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 5.09 | -50.35 | 0 | 6 | -1 | 80 | 334.421 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.