UCSF

ZINC13011341

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2008 35 Yes

Popular Name: 2-[[4-(4-isopropoxy-3-methoxy-benzoyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[3, 2-[[4-(4-isopropoxy-3-methoxy-be…

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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) 2.67 11.26 -70.77 2 8 1 89 497.641 6 ↓
Mid Mid (pH 6-8) 2.67 11.35 -67.26 2 8 1 89 497.641 6 ↓
Mid Mid (pH 6-8) 2.67 9.21 -20.58 1 8 0 88 496.633 6 ↓

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