| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2004 | 29 | No |
Popular Name: 2-[[2-[[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]thio]acetyl]amino]benzoic-acid-methyl-ester 2-[[2-[[3-(3-nitrophenyl)-1H-1,2…
| 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) | 3.47 | 9.47 | -15.19 | 2 | 10 | 0 | 143 | 413.415 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 9.29 | -49.7 | 1 | 10 | -1 | 141 | 412.407 | 8 | ↓ |
