| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 18 | No |
Popular Name: (3R)-3-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)pyrrolidine-2,5-dione (3R)-3-(2,3,4,5-tetrahydro-1,4-b…
| 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) | -0.04 | 2.24 | -56.25 | 3 | 5 | 1 | 66 | 246.29 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.14 | -1.57 | -45.85 | 1 | 5 | -1 | 68 | 244.274 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | -0.31 | -72.59 | 2 | 5 | 0 | 72 | 245.282 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
