UCSF

ZINC09424031

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 26th, 2007 35 No

Popular Name: 1-(6-chlorobenzothiazol-2-yl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-3-hydroxy-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) 4.79 11.27 -54.94 0 7 -1 92 503.943 4 ↓
Mid Mid (pH 6-8) 4.21 11.31 -21.02 0 7 0 86 504.951 4 ↓
Mid Mid (pH 6-8) 5.24 10.29 -30.51 1 7 0 89 504.951 3 ↓

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