In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2009 | 26 | No |
Popular Name: (5E)-5-(5-bromo-2-oxo-indolin-3-ylidene)-2-(3-chloro-2-methyl-anilino)thiazol-4-one (5E)-5-(5-bromo-2-oxo-indolin-3-…
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) | 6.22 | 9.46 | -11.09 | 2 | 5 | 0 | 78 | 448.729 | 1 | ↓ |
Ref Reference (pH 7) | 6.22 | 9.15 | -11.33 | 2 | 5 | 0 | 78 | 448.729 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.68 | 7.37 | -49.96 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.68 | 7.36 | -44.24 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
Mid Mid (pH 6-8) | 7.14 | 5.61 | -113.21 | 0 | 5 | -2 | 84 | 446.713 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.68 | 7.87 | -47.89 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.68 | 7.66 | -43.52 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
Mid Mid (pH 6-8) | 7.14 | 6.11 | -110.84 | 0 | 5 | -2 | 84 | 446.713 | 1 | ↓ |