In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 19 | Yes |
Popular Name: 4-[[5-[(1S)-1-amino-1-methyl-butyl]-1,2,4-oxadiazol-3-yl]methyl]phenol 4-[[5-[(1S)-1-amino-1-methyl-but…
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) | 2.77 | 1.39 | -48.21 | 4 | 5 | 1 | 87 | 262.333 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 1.18 | -6.71 | 3 | 5 | 0 | 85 | 261.325 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.