In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 29 | Yes |
Popular Name: N-(3-pyridylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide N-(3-pyridylmethyl)-2-[4-(triflu…
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) | 3.88 | 6.63 | -13.48 | 1 | 5 | 0 | 68 | 397.356 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.88 | 6.91 | -48.88 | 2 | 5 | 1 | 69 | 398.364 | 5 | ↓ |