In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 20 | No |
Popular Name: methyl 3-{[(1E)-(5-chloro-2-hydroxyphenyl)methylene]amino}benzoate methyl 3-{[(1E)-(5-chloro-2-hydr…
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CAS Number: [1232817-76-3]
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) | 4.21 | 6.56 | -12.88 | 1 | 4 | 0 | 59 | 289.718 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.21 | 7.36 | -48.9 | 0 | 4 | -1 | 62 | 288.71 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.21 | 7.23 | -38.93 | 2 | 4 | 1 | 61 | 290.726 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.