In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2011 | 14 | No |
Popular Name: (1R)-1-[5-[(3R)-tetrahydrothiophen-3-yl]-1,2,4-oxadiazol-3-yl]propan-1-amine (1R)-1-[5-[(3R)-tetrahydrothioph…
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) | -0.97 | 1.52 | -43.7 | 3 | 4 | 1 | 67 | 214.314 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.97 | 1.22 | -6.4 | 2 | 4 | 0 | 65 | 213.306 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.