UCSF

ZINC10509018

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 27 Yes

Popular Name: 3,5,7-trimethyl-N-(3,4,5-trimethoxyphenyl)-9-thia-2-azabicyclo[4.3.0]nona-1,3,5,7-tetraene-8-carboxa 3,5,7-trimethyl-N-(3,4,5-trimeth…

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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) 3.96 -0.21 -13.2 1 6 0 69 386.473 5 ↓
Lo Low (pH 4.5-6) 3.96 -0.17 -39.92 2 6 1 70 387.481 5 ↓

Activity (Go SEA)

Rings

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