In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 27 | Yes |
Popular Name: 2-[[4-allyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(azepan-1-yl)ethanone 2-[[4-allyl-5-(phenoxymethyl)-1,…
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) | 3.54 | 11.91 | -12.89 | 0 | 6 | 0 | 60 | 386.521 | 8 | ↓ |