In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 19 | Yes |
Popular Name: 2-[[5-[(1S)-1-hydroxyethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-thiazol-2-yl-acetamide 2-[[5-[(1S)-1-hydroxyethyl]-4-me…
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) | -0.09 | 2.41 | -20.96 | 2 | 7 | 0 | 93 | 299.381 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.09 | 1.18 | -51.82 | 1 | 7 | -1 | 99 | 298.373 | 5 | ↓ |