UCSF

ZINC13571635

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 22nd, 2008 34 No

Popular Name: (4E,5S)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)-hydroxy-methylene]-5-(3-hydroxyphenyl) (4E,5S)-1-(6-ethyl-1,3-benzothia…

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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) 5.18 10.18 -56.13 1 6 -1 94 473.505 5 ↓
Mid Mid (pH 6-8) 5.63 10.17 -19.88 2 6 0 91 474.513 4 ↓
Mid Mid (pH 6-8) 4.60 10.45 -11.76 1 6 0 88 474.513 5 ↓

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