| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2007 | 23 | No |
Popular Name: 3-[[4-allyl-5-(3-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]butan-2-one 3-[[4-allyl-5-(3-nitrophenyl)-1,…
| 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) | 2.98 | 10.8 | -16.17 | 0 | 7 | 0 | 94 | 332.385 | 7 | ↓ |
