| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2010 | 37 | Yes |
Popular Name: (NE)-N-[cyano-(3-isopropoxypropyl)-methyl-oxo-BLAHylidene]-2-ethoxy-benzamide (NE)-N-[cyano-(3-isopropoxypropy…
| 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) | 4.95 | 14.51 | -27.55 | 0 | 9 | 0 | 111 | 499.571 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.03 | 15.68 | -38.76 | 1 | 9 | 1 | 110 | 500.579 | 9 | ↓ |
