UCSF

ZINC34677624

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Substance Information

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

Popular Name: (4-benzylpiperazin-1-yl)-[2-[[4-[(2R)-2-hydroxy-3-[isopropyl(methyl)amino]propyl]piperazin-1-yl]meth (4-benzylpiperazin-1-yl)-[2-[[4-…

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Annotations

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Vendors

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) 1.19 3.96 -40.85 2 9 1 81 499.68 10 ↓
Mid Mid (pH 6-8) 1.19 6.25 -97.56 3 9 2 82 500.688 10 ↓
Lo Low (pH 4.5-6) 1.19 8.46 -161.32 4 9 3 83 501.696 10 ↓

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