UCSF

ZINC34678328

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 36 Yes

Popular Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methyl]-N-[2-(2-methoxyphenyl)ethyl]oxa 2-[[4-(2,3-dihydro-1,4-benzodiox…

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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) 2.31 5.59 -50.39 2 9 1 91 493.584 9 ↓
Mid Mid (pH 6-8) 2.31 5.61 -50.02 2 9 1 91 493.584 9 ↓
Mid Mid (pH 6-8) 2.31 3.34 -13.54 1 9 0 89 492.576 9 ↓

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