UCSF

ZINC09460774

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 36 No

Popular Name: 1-(6-chlorobenzothiazol-2-yl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-yl-hydroxy-methylene)-5- 1-(6-chlorobenzothiazol-2-yl)-4-…

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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) 5.24 12.01 -61.08 0 7 -1 92 517.97 4 ↓
Mid Mid (pH 6-8) 5.69 11.44 -21.78 1 7 0 89 518.978 3 ↓
Mid Mid (pH 6-8) 4.66 12.27 -14.93 0 7 0 86 518.978 4 ↓

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