In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2010 | 15 | No |
Popular Name: 5-propyl-4-(thiazol-2-ylmethyl)-1,2,4-triazole-3-thiol 5-propyl-4-(thiazol-2-ylmethyl)-…
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) | 1.59 | 6.49 | -51.49 | 0 | 4 | -1 | 44 | 239.349 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.87 | 6.59 | -15.88 | 1 | 4 | 0 | 47 | 240.357 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.