UCSF

ZINC04891048

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2006 18 No

Popular Name: 3-(4-bromophenyl)-1,4-diazaspiro[4.5]dec-3-ene-2-thione 3-(4-bromophenyl)-1,4-diazaspiro…

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CAS Numbers: 899935-98-9 , [899935-98-9]

Other Names:

MFCD02311201

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) 4.72 6.36 -5.02 1 2 0 26 323.259 1 ↓

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

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