In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 25 | Yes |
Popular Name: N-benzyl-2-[4-[(4-bromophenyl)methyl]piperazin-1-yl]acetamide N-benzyl-2-[4-[(4-bromophenyl)me…
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) | 3.45 | 8.52 | -40.11 | 2 | 4 | 1 | 37 | 403.344 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 6.29 | -8.4 | 1 | 4 | 0 | 36 | 402.336 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 8.76 | -42.29 | 2 | 4 | 1 | 37 | 403.344 | 6 | ↓ |