In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 14 | Yes |
Popular Name: (2S)-N-[2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethyl]butan-2-amine (2S)-N-[2-[(5-methyl-4H-1,2,4-tr…
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) | 1.39 | 4.89 | -42.43 | 3 | 4 | 1 | 58 | 215.346 | 6 | ↓ |