UCSF

ZINC09176885

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 12th, 2007 36 No

Popular Name: 4-[(2,4-dimethylthiazol-5-yl)-hydroxy-methylene]-1-(2-morpholinoethyl)-5-(3,4,5-trimethoxyphenyl)-py 4-[(2,4-dimethylthiazol-5-yl)-hy…

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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) 0.99 4.64 -60.33 0 10 -1 114 516.596 9 ↓
Mid Mid (pH 6-8) 1.44 6.96 -50.52 2 10 1 112 518.612 8 ↓
Mid Mid (pH 6-8) 0.41 -1.77 -56.89 1 10 1 108 518.612 9 ↓
Mid Mid (pH 6-8) 0.99 6.98 -74.42 1 10 0 115 517.604 9 ↓

Activity (Go SEA)

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