In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 24 | Yes |
Popular Name: N-[(1S)-2-(4-benzylpiperazin-1-yl)-1-methyl-ethyl]-2-ethyl-butanamide N-[(1S)-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) | 3.20 | 8.4 | -42.03 | 2 | 4 | 1 | 37 | 332.512 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 8.86 | -42.72 | 2 | 4 | 1 | 37 | 332.512 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 6.48 | -6.5 | 1 | 4 | 0 | 36 | 331.504 | 8 | ↓ |