In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 17 | No |
Popular Name: 1-ethyl-4-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-piperazine 1-ethyl-4-(2-methyl-5-nitro-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) | 0.43 | 10.17 | -48.9 | 1 | 8 | 1 | 84 | 241.275 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.43 | 7.92 | -9.14 | 0 | 8 | 0 | 83 | 240.267 | 3 | ↓ |