UCSF

ZINC53092958

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2010 24 Yes

Popular Name: 10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-; 2-Ethyl-8-methyl-4-(4-methyl-1-piperazinyl)-10H-thieno(2,3-b)(1,5)benzodiazepine; BRN 1034585; LS-152286 10H-Thieno(2,3-b)(1,5)benzodiaze…

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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) 4.47 8.34 -7.55 1 4 0 35 340.496 2 ↓
Mid Mid (pH 6-8) 4.47 10.69 -41.49 2 4 1 36 341.504 2 ↓
Lo Low (pH 4.5-6) 0.42 11.18 -93.47 3 4 2 39 342.512 1 ↓

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