UCSF

ZINC34944440

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Substance Information

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

Popular Name: (4E,5S)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)-5-(3,4,5-trimethoxyphenyl)p (4E,5S)-4-[(2,5-dimethylphenyl)-…

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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) 2.71 7.55 -45.84 0 9 -1 101 509.579 9 ↓
Mid Mid (pH 6-8) 2.71 9.82 -57.49 1 9 0 102 510.587 9 ↓
Lo Low (pH 4.5-6) 2.71 9.07 -52.63 2 9 1 99 511.595 9 ↓

Activity (Go SEA)

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