In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 22 | Yes |
Popular Name: 4-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]morpholine 4-[2-[(4-ethyl-5-phenyl-1,2,4-tr…
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) | 2.75 | 7.41 | -11.44 | 0 | 5 | 0 | 43 | 318.446 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 9.68 | -44.22 | 1 | 5 | 1 | 44 | 319.454 | 6 | ↓ |