UCSF

ZINC09242433

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 33 No

Popular Name: 5-(4-dimethylaminophenyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-yl-hydroxy-methylene)-1-(3-m 5-(4-dimethylaminophenyl)-4-(2,5…

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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) 2.24 7.79 -63.38 0 8 -1 91 451.499 8 ↓
Mid Mid (pH 6-8) 2.79 6.15 -7.88 0 5 0 52 335.787 2 ↓

Activity (Go SEA)

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