In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 27 | Yes |
Popular Name: methyl-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]methyl]BLAHone methyl-[[4-(3-methyl-1,2,4-oxadi…
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) | 0.63 | 9.48 | -63.52 | 1 | 9 | 1 | 96 | 386.461 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.63 | 7.24 | -18.74 | 0 | 9 | 0 | 94 | 385.453 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.