In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 34 | No |
Popular Name: N-benzyl-N-ethyl-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]oxazole-4-carboxamide N-benzyl-N-ethyl-2-[[4-[(2-nitro…
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) | 2.92 | 12.09 | -52.28 | 1 | 9 | 1 | 100 | 464.546 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 11.56 | -46.26 | 1 | 9 | 1 | 100 | 464.546 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 9.83 | -14.43 | 0 | 9 | 0 | 99 | 463.538 | 9 | ↓ |