UCSF

ZINC08905408

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 34 No

Popular Name: 5-(2,3-dimethoxyphenyl)-1-(3-dimethylaminopropyl)-4-[hydroxy-(4-methoxy-2-methyl-phenyl)-methylene]- 5-(2,3-dimethoxyphenyl)-1-(3-dim…

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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) 2.93 10.39 -76.39 1 8 0 93 468.55 10 ↓
Mid Mid (pH 6-8) 2.35 11.42 -51.29 1 8 1 87 469.558 10 ↓
Mid Mid (pH 6-8) 3.38 10.49 -48.61 2 8 1 90 469.558 9 ↓

Activity (Go SEA)

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