UCSF

ZINC67172575

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2011 19 No

Popular Name: 3-(3-methylphenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione 3-(3-methylphenyl)-1,4-diazaspir…

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CAS Numbers: 1325305-60-9 , [1325305-60-9]

Other Names:

MFCD19705649

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) 4.84 7.04 -5.78 1 2 0 26 272.417 1 ↓

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

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