In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2006 | 21 | No |
Popular Name: 2-methoxy-5-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol 2-methoxy-5-({[3-sulfanyl-5-(tri…
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) | 1.95 | 5.16 | -45.14 | 1 | 6 | -1 | 73 | 317.272 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 6.08 | -91.89 | 0 | 6 | -2 | 75 | 316.264 | 4 | ↓ |