UCSF

ZINC53313016

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 43 No

Popular Name: (E)-1-[2-(4-chlorophenyl)-4-hydroxy-6-methyl-3-[(E)-3-(2-naphthyl)prop-2-enoyl]phenyl]-3-(2-naphthyl (E)-1-[2-(4-chlorophenyl)-4-hydr…

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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) 9.32 20.5 -12.22 1 3 0 54 579.095 7 ↓
Mid Mid (pH 6-8) 9.32 21.3 -52.94 0 3 -1 57 578.087 7 ↓

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

No pre-computed analogs available. Try a structural similarity search.