In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 27 | Yes |
Popular Name: 2-[[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-N-isobutyl-oxazole-4-carboxamide 2-[[4-[(4-fluorophenyl)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) | 2.28 | 5.11 | -48.08 | 2 | 6 | 1 | 63 | 375.468 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 5.16 | -47.23 | 2 | 6 | 1 | 63 | 375.468 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 2.86 | -8.1 | 1 | 6 | 0 | 62 | 374.46 | 7 | ↓ |