In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 19 | No |
Popular Name: 3-[[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]methyl]thiazolidine-2-thione 3-[[(3S)-3-(3-methyl-1,2,4-oxadi…
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) | 1.23 | 3.9 | -15.55 | 0 | 5 | 0 | 45 | 298.437 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.23 | 6.23 | -53.54 | 1 | 5 | 1 | 47 | 299.445 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.