In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 25 | Yes |
Popular Name: 2-[(4,5-diethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide 2-[(4,5-diethyl-1,2,4-triazol-3-…
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) | 2.81 | 8.62 | -17.89 | 1 | 7 | 0 | 82 | 377.495 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.99 | 7.19 | -51.54 | 0 | 7 | -1 | 88 | 376.487 | 7 | ↓ |