In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 20th, 2011 | 18 | Yes |
Popular Name: 1-[4-(5-methyl-1H-pyrazole-4-carbonyl)-1,4-diazepan-1-yl]ethanone 1-[4-(5-methyl-1H-pyrazole-4-car…
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) | -1.04 | 3.48 | -11.41 | 1 | 6 | 0 | 69 | 250.302 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.