| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 19 | No |
Popular Name: N-[(1S)-1-(3-isobutyl-1,2,4-oxadiazol-5-yl)ethyl]-1,4-dithiepan-6-amine N-[(1S)-1-(3-isobutyl-1,2,4-oxad…
| 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) | 2.35 | 5.46 | -43.38 | 2 | 4 | 1 | 56 | 302.489 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 4.43 | -6.67 | 1 | 4 | 0 | 51 | 301.481 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
