UCSF

ZINC17180457

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 36 No

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

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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) 2.74 9.78 -56.03 1 9 0 102 498.576 11 ↓
Mid Mid (pH 6-8) 3.19 9.33 -45.68 2 9 1 99 499.584 10 ↓

Activity (Go SEA)

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