In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 28 | Yes |
Popular Name: 2-[[4-benzyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-propan-1-one 2-[[4-benzyl-5-(4-pyridyl)-1,2,4…
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) | 2.92 | 0 | -12.4 | 0 | 6 | 0 | 63 | 393.516 | 6 | ↓ |