In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 21 | Yes |
Popular Name: (1S)-1-[3-(2-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-phenyl-ethanamine (1S)-1-[3-(2-bromophenyl)-1,2,4-…
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) | 4.22 | 6 | -48.75 | 3 | 4 | 1 | 67 | 345.22 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 5.72 | -9.31 | 2 | 4 | 0 | 65 | 344.212 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.