In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 24 | Yes |
Popular Name: 3-[2-(4-propoxyphenoxy)ethylsulfanyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine 3-[2-(4-propoxyphenoxy)ethylsulf…
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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) | 4.19 | 10.47 | -12.03 | 0 | 5 | 0 | 49 | 347.484 | 8 | ↓ |