In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 22 | No |
Popular Name: 2-anilino-5-[(5-bromo-2-hydroxy-phenyl)methylene]thiazol-4-one 2-anilino-5-[(5-bromo-2-hydroxy-…
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) | 5.37 | 5.99 | -9.37 | 2 | 4 | 0 | 65 | 375.247 | 2 | ↓ |
Ref Reference (pH 7) | 4.88 | 5.38 | -44.3 | 1 | 4 | -1 | 64 | 374.239 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.88 | 6.15 | -95.9 | 0 | 4 | -2 | 67 | 373.231 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.37 | 6.34 | -36.49 | 1 | 4 | -1 | 68 | 374.239 | 2 | ↓ |
Hi High (pH 8-9.5) | 5.37 | 6.77 | -36.05 | 1 | 4 | -1 | 68 | 374.239 | 2 | ↓ |