In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 28 | Yes |
Popular Name: (2S)-2-[[4-allyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-propanamide (2S)-2-[[4-allyl-5-(phenoxymethy…
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) | 4.15 | 11.16 | -12.5 | 1 | 6 | 0 | 69 | 400.548 | 9 | ↓ |