In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 35 | Yes |
Popular Name: 3-[benzyl-[2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-amino]propanamide 3-[benzyl-[2-[[4-benzyl-5-(3-pyr…
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) | 2.77 | -1.87 | -19.64 | 2 | 8 | 0 | 107 | 486.601 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.