In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2006 | 26 | No |
Popular Name: N-(2-chloro-5-nitro-phenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(2-chloro-5-nitro-phenyl)-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) | 3.79 | 9.05 | -24.47 | 2 | 8 | 0 | 116 | 389.824 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.79 | 8.89 | -50.42 | 1 | 8 | -1 | 115 | 388.816 | 6 | ↓ |