| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 18 | Yes |
Popular Name: 2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl-[(3S)-tetrahydrofuran-3-yl]methanone 2,3,4,5-tetrahydro-1,4-benzodiaz…
| 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) | 1.22 | 4.66 | -54.01 | 2 | 4 | 1 | 46 | 247.318 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 3.4 | -10.99 | 1 | 4 | 0 | 42 | 246.31 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
