In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 1st, 2010 | 23 | Yes |
Popular Name: 4-[3-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-5-yl]pyridine 4-[3-[(4-tert-butylphenoxy)methy…
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) | 3.68 | 8.25 | -9.58 | 1 | 5 | 0 | 64 | 308.385 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.68 | 8.13 | -42.73 | 0 | 5 | -1 | 62 | 307.377 | 5 | ↓ |