In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 20 | Yes |
Popular Name: (2R)-N,4-dimethyl-N-[[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]pentan-2-amine (2R)-N,4-dimethyl-N-[[3-(4-pyrid…
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) | 2.54 | 6.23 | -42.04 | 1 | 5 | 1 | 56 | 275.376 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 6.69 | -88.68 | 2 | 5 | 2 | 57 | 276.384 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.