In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 19 | No |
Popular Name: 3-[(E)-(3-bromo-4-hydroxy-5-methoxy-benzylidene)amino]-2-thioxo-thiazolidin-4-one 3-[(E)-(3-bromo-4-hydroxy-5-meth…
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) | 2.20 | 4.47 | -14.88 | 1 | 5 | 0 | 62 | 361.242 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 5.39 | -50.31 | 0 | 5 | -1 | 65 | 360.234 | 3 | ↓ |