In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 30 | Yes |
Popular Name: N-[(1R)-2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-4-tert-butyl-benzamide N-[(1R)-2-(4-benzylpiperazin-1-y…
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) | 3.81 | 9.36 | -8.85 | 1 | 5 | 0 | 53 | 407.558 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 11.58 | -47.24 | 2 | 5 | 1 | 54 | 408.566 | 6 | ↓ |