In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | No |
Popular Name: (1S)-1-[3-(3-furyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfanyl-propan-1-amine (1S)-1-[3-(3-furyl)-1,2,4-oxadia…
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) | -0.72 | 1.63 | -54.87 | 3 | 5 | 1 | 80 | 240.308 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.72 | 1.3 | -10.26 | 2 | 5 | 0 | 78 | 239.3 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.