In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 30 | No |
Popular Name: (2S)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-nitrophenyl)butanamide (2S)-2-[[4-methyl-5-(phenoxymeth…
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) | 3.76 | 11.24 | -20.26 | 1 | 9 | 0 | 115 | 427.486 | 9 | ↓ |