| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 18 | Yes |
Popular Name: N-methyl-N-[3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propyl]ethane-1,2-diamine N-methyl-N-[3-[3-(2-thienyl)-1,2…
| 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) | 1.11 | 3.49 | -124.72 | 4 | 5 | 2 | 71 | 268.386 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 3.1 | -44 | 3 | 5 | 1 | 69 | 267.378 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 1.18 | -49.81 | 3 | 5 | 1 | 70 | 267.378 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
