In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 23 | Yes |
Popular Name: (2S)-2-[3-amino-5-(cyanomethylsulfanyl)-1,2,4-triazol-4-yl]-N-(m-tolyl)butanamide (2S)-2-[3-amino-5-(cyanomethylsu…
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) | 2.06 | 8.65 | -15.72 | 3 | 7 | 0 | 110 | 330.417 | 6 | ↓ |