In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2008 | 25 | No |
Popular Name: 2-[(5-hydroxy-4-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-4-nitro-phenyl)acetamide 2-[(5-hydroxy-4-propyl-1,2,4-tri…
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) | 1.65 | 4.77 | -20.7 | 2 | 10 | 0 | 135 | 367.387 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 3.99 | -52.59 | 1 | 10 | -1 | 138 | 366.379 | 8 | ↓ |