| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 21 | Yes |
Popular Name: 3-fluoro-4-(1-methyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)benzonitrile 3-fluoro-4-(1-methyl-3,5-dihydro…
None
| 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) | 3.20 | 10.34 | -5.15 | 0 | 3 | 0 | 30 | 281.334 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 10.35 | -41.33 | 1 | 3 | 1 | 31 | 282.342 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
