In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2004 | 31 | No |
Popular Name: 4-({2-[(2-chlorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)phenyl 3-methylbenzoate 4-({2-[(2-chlorophenyl)imino]-4-…
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) | 7.56 | 13.58 | -14.7 | 1 | 5 | 0 | 72 | 448.931 | 5 | ↓ |
Ref Reference (pH 7) | 7.56 | 13.87 | -14.28 | 1 | 5 | 0 | 72 | 448.931 | 5 | ↓ |
Hi High (pH 8-9.5) | 8.02 | 11.8 | -51 | 0 | 5 | -1 | 75 | 447.923 | 5 | ↓ |
Hi High (pH 8-9.5) | 8.02 | 12.29 | -48.42 | 0 | 5 | -1 | 75 | 447.923 | 5 | ↓ |