| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2011 | 24 | No |
Popular Name: 1-(1-methyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)-2-(2-nitrophenyl)ethanone 1-(1-methyl-3,5-dihydro-2H-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) | 2.69 | 10.37 | -15.05 | 0 | 6 | 0 | 69 | 325.368 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.69 | 10.41 | -41.56 | 1 | 6 | 1 | 71 | 326.376 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
