In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 17 | No |
Popular Name: 2-{[(4-methoxyphenyl)imino]methyl}phenol 2-{[(4-methoxyphenyl)imino]methy…
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CAS Numbers: 889-08-7 , [889-08-7]
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) | 3.47 | 4.7 | -7.48 | 1 | 3 | 0 | 42 | 227.263 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.47 | 5.48 | -48.51 | 0 | 3 | -1 | 45 | 226.255 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.47 | 4.26 | -40.88 | 0 | 3 | -1 | 45 | 226.255 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.47 | 3.93 | -33.89 | 2 | 3 | 1 | 43 | 228.271 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.47 | 5.38 | -31.4 | 2 | 3 | 1 | 43 | 228.271 | 3 | ↓ |