In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: 2-[5-[(4,4-diethyl-1-piperidyl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-[(4,4-diethyl-1-piperidyl)m…
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) | 2.26 | 4.29 | -100.64 | 4 | 5 | 2 | 71 | 282.432 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 4.03 | -40.62 | 3 | 5 | 1 | 69 | 281.424 | 5 | ↓ |