In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2010 | 28 | No |
Popular Name: N-[4-[(1R)-1-methylpropoxy]phenyl]-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide N-[4-[(1R)-1-methylpropoxy]pheny…
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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) | 4.09 | 11.2 | -18.34 | 2 | 6 | 0 | 72 | 396.516 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.82 | 11.35 | -56.47 | 1 | 6 | -1 | 69 | 395.508 | 7 | ↓ |