| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2010 | 18 | No |
Popular Name: 3-(3-nitrophenyl)-5-prop-2-ynylsulfanyl-4H-1,2,4-triazole 3-(3-nitrophenyl)-5-prop-2-ynyls…
| 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) | 2.52 | 7.7 | -10.57 | 1 | 6 | 0 | 87 | 260.278 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 7.5 | -43.36 | 0 | 6 | -1 | 86 | 259.27 | 4 | ↓ |
