UCSF

ZINC53107982

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2010 25 Yes

Popular Name: 10H-Thieno(2,3-b)(1,5)benzodiazepine, 2-ethyl-4-(4-propyl-1-piperazinyl)-; 2-Ethyl-4-(4-propyl-1-piperazinyl)-10H-thieno(2,3-b)(1,5)benzodiazepine; BRN 5623348; LS-152294 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) 4.92 9.26 -7.44 1 4 0 35 354.523 4 ↓
Mid Mid (pH 6-8) 4.92 11.46 -40.77 2 4 1 36 355.531 4 ↓
Lo Low (pH 4.5-6) 0.88 11.93 -94.5 3 4 2 39 356.539 3 ↓

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