UCSF

ZINC32131087

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 25 Yes

Popular Name: 5H-Dibenzo(b,e)(1,4)diazepine, 8-chloro-2-methoxy-11-(4-methyl-1-piperazinyl)-, (Z)-2-butenedioate (1:1); 8-Chloro-2-methoxy-11-(4-methylpiperazino)-5H-dibenzo(b,e)-1,4-diazepine maleate; LS-60879; VUFB-12325 5H-Dibenzo(b,e)(1,4)diazepine, 8…

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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) 4.18 6.84 -7.26 1 5 0 44 356.857 2 ↓
Mid Mid (pH 6-8) 4.18 9.18 -40.87 2 5 1 46 357.865 2 ↓

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