In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 18 | No |
Popular Name: (1S)-3-methylsulfonyl-1-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propan-1-amine (1S)-3-methylsulfonyl-1-[3-(2-th…
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) | -1.01 | -0.81 | -74.29 | 3 | 6 | 1 | 101 | 288.374 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.01 | -1.12 | -18.43 | 2 | 6 | 0 | 99 | 287.366 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.