| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 19 | Yes |
Popular Name: 1-pyrrolidin-1-yl-2-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)ethanone 1-pyrrolidin-1-yl-2-(2,3,4,5-tet…
| 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) | 1.17 | 6.75 | -48.76 | 2 | 4 | 1 | 40 | 260.361 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 5.49 | -10.17 | 1 | 4 | 0 | 36 | 259.353 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
