In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 30 | No |
Popular Name: 4-methyl-N-[(5Z)-4-oxo-5-[(4-pentoxyphenyl)methylene]-2-thioxo-thiazolidin-3-yl]benzamide 4-methyl-N-[(5Z)-4-oxo-5-[(4-pen…
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) | 5.13 | 12.47 | -16.74 | 1 | 5 | 0 | 60 | 440.59 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.20 | 10.82 | -61.07 | 0 | 5 | -1 | 67 | 439.582 | 8 | ↓ |