In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 29 | Yes |
Popular Name: 3-methyl-N-[(1S)-2-(4-methylpiperazin-1-yl)-2-oxo-1-phenyl-ethyl]-3-phenyl-butanamide 3-methyl-N-[(1S)-2-(4-methylpipe…
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) | 3.29 | 8.57 | -8.22 | 1 | 5 | 0 | 53 | 393.531 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 10.92 | -45.32 | 2 | 5 | 1 | 54 | 394.539 | 6 | ↓ |