In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 16 | No |
Popular Name: 5-(3-chloropropyl)-3-(4-pyridylmethyl)-1,2,4-oxadiazole 5-(3-chloropropyl)-3-(4-pyridylm…
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) | 1.76 | 4.62 | -10.29 | 0 | 4 | 0 | 52 | 237.69 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 5.08 | -37.73 | 1 | 4 | 1 | 53 | 238.698 | 5 | ↓ |