UCSF

ZINC35025881

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 37 No

Popular Name: (4E,5R)-5-(4-allyloxyphenyl)-4-[hydroxy-(4-methoxy-2-methyl-phenyl)methylene]-1-(3-morpholinopropyl) (4E,5R)-5-(4-allyloxyphenyl)-4-[…

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Physical Representations

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) 3.66 8.78 -60.37 0 8 -1 91 505.591 11 ↓
Mid Mid (pH 6-8) 3.66 11.06 -73.21 1 8 0 93 506.599 11 ↓
Lo Low (pH 4.5-6) 3.66 10.17 -47.11 2 8 1 90 507.607 11 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )