In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 25 | Yes |
Popular Name: 2-[[4-allyl-5-(morpholinomethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-acetamide 2-[[4-allyl-5-(morpholinomethyl)…
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) | 0.64 | 4.78 | -17.73 | 1 | 8 | 0 | 85 | 380.499 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.82 | 3.7 | -44.19 | 0 | 8 | -1 | 92 | 379.491 | 8 | ↓ |