UCSF

ZINC13745705

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 24th, 2008 32 Yes

Popular Name: 4-[12-(4-quinolyl)dodecyl]quinoline 4-[12-(4-quinolyl)dodecyl]quinoline

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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) 8.90 18.03 -11.47 0 2 0 26 424.632 13 ↓
Lo Low (pH 4.5-6) 8.90 18.31 -35.15 1 2 1 27 425.64 13 ↓
Lo Low (pH 4.5-6) 8.90 18.6 -64.52 2 2 2 28 426.648 13 ↓

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