In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 25 | Yes |
Popular Name: 2-[[4-[(2R)-2-hydroxyhexyl]piperazin-1-yl]methyl]-N-propyl-oxazole-4-carboxamide 2-[[4-[(2R)-2-hydroxyhexyl]piper…
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) | 1.77 | 1.33 | -44.22 | 3 | 7 | 1 | 83 | 353.487 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.77 | -0.96 | -8.43 | 2 | 7 | 0 | 82 | 352.479 | 10 | ↓ |
Lo Low (pH 4.5-6) | 1.77 | 1.31 | -43.21 | 3 | 7 | 1 | 83 | 353.487 | 10 | ↓ |