In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2006 | 19 | Yes |
Popular Name: 1-(5-ethyl-3H-1,3,4-thiadiazol-2-ylidene)-3-(3-methoxyphenyl)-urea 1-(5-ethyl-3H-1,3,4-thiadiazol-2…
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) | 2.18 | 4.08 | -25.05 | 2 | 6 | 0 | 76 | 278.337 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.81 | 2.92 | -53.09 | 1 | 6 | -1 | 82 | 277.329 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.