In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 21 | No |
Popular Name: 2-methoxy-1-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]ethanone 2-methoxy-1-[4-(5-nitro-2-pyridy…
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) | 0.74 | 6.46 | -17.4 | 0 | 8 | 0 | 91 | 294.311 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.