In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 31 | No |
Popular Name: N-cyclohexyl-2-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]oxazole-4-carboxamide N-cyclohexyl-2-[[4-[(2-nitrophen…
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) | 2.81 | 7.29 | -50.18 | 2 | 9 | 1 | 109 | 428.513 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.81 | 4.99 | -13.12 | 1 | 9 | 0 | 107 | 427.505 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.81 | 6.93 | -44.77 | 2 | 9 | 1 | 109 | 428.513 | 7 | ↓ |