In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: 3-chloro-4-[3-(4-pyridylmethyl)-1,2,4-oxadiazol-5-yl]aniline 3-chloro-4-[3-(4-pyridylmethyl)-…
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) | 2.07 | 4.57 | -10.25 | 2 | 5 | 0 | 78 | 286.722 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 5.03 | -36.21 | 3 | 5 | 1 | 79 | 287.73 | 3 | ↓ |