In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: 2-(4-aminophenyl)sulfanyl-N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)acetamide 2-(4-aminophenyl)sulfanyl-N-(3-p…
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) | 2.57 | 5.56 | -11.59 | 3 | 5 | 0 | 81 | 340.499 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 4.13 | -39.94 | 2 | 5 | -1 | 87 | 339.491 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.