UCSF

ZINC04473281

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2005 29 No

Popular Name: 2-cyanoethyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate 2-cyanoethyl 5-cyano-6-[(2-ethox…

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Other Names:

MFCD02949093

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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) 3.35 3.17 -14.03 0 7 0 112 411.483 10 ↓
Mid Mid (pH 6-8) 2.97 3.53 -17.55 0 7 0 112 411.483 10 ↓

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