UCSF

ZINC60024302

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 45 No

Popular Name: (1R,2Z,4E,5S)-2,4-dibenzylidene-1,5-bis(4-methoxyphenyl)-9-thioxo-8,10-diazaspiro[5.5]undecane-3,7,1 (1R,2Z,4E,5S)-2,4-dibenzylidene-…

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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) 7.24 11.95 -39.64 1 7 -1 100 613.715 6 ↓
Lo Low (pH 4.5-6) 7.38 13.64 -11.95 2 7 0 94 614.723 6 ↓

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

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