In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2006 | 23 | No |
Popular Name: 2-anilino-5-[(5-bromo-2-methoxy-phenyl)methylene]thiazol-4-one 2-anilino-5-[(5-bromo-2-methoxy-…
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) | 5.43 | 8.46 | -8.22 | 1 | 4 | 0 | 54 | 389.274 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.89 | 6.93 | -45.15 | 0 | 4 | -1 | 58 | 388.266 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.89 | 6.26 | -46.99 | 0 | 4 | -1 | 58 | 388.266 | 3 | ↓ |