In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 23 | No |
Popular Name: N'-[2-[4-[(4-bromophenyl)methyl]piperazin-1-yl]ethyl]-N-methyl-oxamide N'-[2-[4-[(4-bromophenyl)methyl]…
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) | 0.65 | 2.84 | -47.73 | 3 | 6 | 1 | 66 | 384.298 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.65 | 2.83 | -47.02 | 3 | 6 | 1 | 66 | 384.298 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.65 | 0.45 | -8.42 | 2 | 6 | 0 | 65 | 383.29 | 6 | ↓ |