UCSF

ZINC34941356

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 37 No

Popular Name: (4E,5R)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-(2-morpholinoethyl)p (4E,5R)-4-[(3-butoxyphenyl)-hydr…

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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) 3.06 5.45 -63.62 1 9 -1 112 509.579 11 ↓
Mid Mid (pH 6-8) 3.06 7.73 -75.61 2 9 0 113 510.587 11 ↓
Lo Low (pH 4.5-6) 3.06 6.99 -57.47 3 9 1 110 511.595 11 ↓

Activity (Go SEA)

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