In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 26 | Yes |
Popular Name: N,N-diethyl-3-[3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]propanamide N,N-diethyl-3-[3-[(4-ethylsulfon…
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) | 0.03 | 2.08 | -16.91 | 0 | 9 | 0 | 100 | 387.506 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 4.32 | -54.27 | 1 | 9 | 1 | 101 | 388.514 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.