In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 27 | Yes |
Popular Name: 2-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-N-isobutyl-oxazole-4-carboxamide 2-[[4-[(2-chlorophenyl)methyl]pi…
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) | 2.74 | 5.54 | -44.31 | 2 | 6 | 1 | 63 | 391.923 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 5.53 | -39.37 | 2 | 6 | 1 | 63 | 391.923 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 3.24 | -7.79 | 1 | 6 | 0 | 62 | 390.915 | 7 | ↓ |