In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 28 | Yes |
Popular Name: N-(3-morpholinophenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3-morpholinophenyl)-2-[(5-phe…
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) | 3.15 | 7.74 | -13.31 | 2 | 7 | 0 | 83 | 395.488 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 7.54 | -49.16 | 1 | 7 | -1 | 81 | 394.48 | 6 | ↓ |