In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 20 | No |
Popular Name: 2-chloro-1-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]ethanone 2-chloro-1-[4-(5-nitro-2-pyridyl…
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) | 1.36 | 7.79 | -16.11 | 0 | 7 | 0 | 82 | 298.73 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.