| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 24th, 2010 | 31 | No |
Popular Name: (E)-2-cyano-N-[5-[(4-isopropylphenyl)methyl]thiazol-2-yl]-3-(4-nitrophenyl)prop-2-enamide (E)-2-cyano-N-[5-[(4-isopropylph…
| 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) | 5.92 | 13.64 | -15.56 | 1 | 7 | 0 | 112 | 432.505 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.10 | 11.68 | -42.35 | 0 | 7 | -1 | 118 | 431.497 | 7 | ↓ |
