In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 31st, 2006 | 25 | Yes |
Popular Name: N-(4-acetylaminophenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide N-(4-acetylaminophenyl)-2-[(5-ox…
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) | 1.28 | 5.23 | -19.54 | 3 | 8 | 0 | 109 | 363.443 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 3.46 | -63.99 | 2 | 8 | -1 | 112 | 362.435 | 7 | ↓ |