In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 30 | No |
Popular Name: (2E,5S)-5-[3-(trifluoromethyl)benzyl]-2-[(E)-veratrylidenehydrazono]thiazolidin-4-one (2E,5S)-5-[3-(trifluoromethyl)be…
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) | 3.46 | 9.74 | -12.28 | 1 | 6 | 0 | 72 | 437.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 8.66 | -41.97 | 0 | 6 | -1 | 74 | 436.435 | 8 | ↓ |