In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2007 | 28 | Yes |
Popular Name: 2-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-morpholinosulfonylphenyl)-acetamide 2-[(5-cyclopropyl-4H-1,2,4-triaz…
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) | 0.70 | 3.81 | -15.86 | 2 | 9 | 0 | 117 | 423.52 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 3.62 | -48.56 | 1 | 9 | -1 | 116 | 422.512 | 7 | ↓ |