In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 22 | Yes |
Popular Name: 3-(3-phenylpropylsulfanyl)-5-(p-tolyl)-4H-1,2,4-triazole 3-(3-phenylpropylsulfanyl)-5-(p-…
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) | 5.20 | 11.76 | -7.57 | 1 | 3 | 0 | 42 | 309.438 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.20 | 11.67 | -8.63 | 1 | 3 | 0 | 42 | 309.438 | 6 | ↓ |