UCSF

ZINC10519406

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 24 Yes

Popular Name: 3,5,7-trimethyl-N-(4,5,6,7-tetrahydrobenzothiazol-2-yl)-9-thia-2-azabicyclo[4.3.0]nona-1,3,5,7-tetra 3,5,7-trimethyl-N-(4,5,6,7-tetra…

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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) 4.62 -2.58 -13.17 1 4 0 54 357.504 2 ↓
Lo Low (pH 4.5-6) 4.62 -2.54 -37.9 2 4 1 56 358.512 2 ↓

Activity (Go SEA)

Rings

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