In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 19 | Yes |
Popular Name: 4-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]piperazine-1-sulfonamide 4-[(5-ethoxy-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) | -0.73 | -4.68 | -13.86 | 2 | 8 | 0 | 102 | 307.401 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.73 | -4.19 | -44.38 | 1 | 8 | -1 | 99 | 306.393 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.73 | -2.46 | -53.16 | 3 | 8 | 1 | 103 | 308.409 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.