In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 23 | No |
Popular Name: (2E)-N-allyl-2-cyano-2-[3-(4-ethylphenyl)-4-oxo-thiazolidin-2-ylidene]acetamide (2E)-N-allyl-2-cyano-2-[3-(4-eth…
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) | 2.37 | 7.63 | -11.87 | 1 | 5 | 0 | 73 | 327.409 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 5.63 | -43.82 | 0 | 5 | -1 | 80 | 326.401 | 5 | ↓ |