| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 20 | Yes |
Popular Name: 3-isopropyl-5-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-ylmethyl)-1,2,4-oxadiazole 3-isopropyl-5-(2,3,4,5-tetrahydr…
| 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) | 1.95 | 5.17 | -50.13 | 2 | 5 | 1 | 59 | 273.36 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 3.93 | -7.96 | 1 | 5 | 0 | 54 | 272.352 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
