In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2004 | 29 | Yes |
Popular Name: 2-[[4-allyl-5-(7-methoxybenzofuran-2-yl)-1,2,4-triazol-3-yl]thio]-N-thiazol-2-yl-acetamide 2-[[4-allyl-5-(7-methoxybenzofur…
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) | 3.45 | 9.44 | -19.21 | 1 | 8 | 0 | 95 | 427.511 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 8.21 | -48.38 | 0 | 8 | -1 | 101 | 426.503 | 8 | ↓ |