UCSF

ZINC00093786

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 24 Yes

Popular Name: 1-Isonicotinoyl-4-(2-quinolyl)piperazine monohydrochloride; LS-112730; Piperazine, 1-(4-pyridinylcarbonyl)-4-(2-quinolinyl)-, monohydrochloride; Piperazine, 1-isonicotinoyl-4-(2-quinolyl)-, monohydrochloride 1-Isonicotinoyl-4-(2-quinolyl)pi…

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Other Names:

MFCD00377906

Download: MOL2 SDF SMILES Flexibase

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) 1.55 -2.65 -36.64 1 5 1 50 319.388 2 ↓

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