In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 27 | Yes |
Popular Name: N-[(2S)-2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-3,4-difluoro-benzamide N-[(2S)-2-(4-chlorophenyl)-2-(4-…
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) | 3.57 | 8.91 | -47.45 | 2 | 4 | 1 | 37 | 394.873 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 6.53 | -10.83 | 1 | 4 | 0 | 36 | 393.865 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.