In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 38 | No |
Popular Name: [4-(benzylBLAHyl)piperazin-1-yl]-(3-nitrophenyl)methanone [4-(benzylBLAHyl)piperazin-1-yl]…
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) | 5.66 | 16.58 | -16.43 | 0 | 8 | 0 | 95 | 527.65 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.