In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 28 | Yes |
Popular Name: 2-[[4-isopentyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-acetamide 2-[[4-isopentyl-5-(phenoxymethyl…
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) | 3.65 | 10.81 | -18.65 | 1 | 7 | 0 | 82 | 417.56 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.83 | 9.73 | -45.54 | 0 | 7 | -1 | 88 | 416.552 | 10 | ↓ |