UCSF

ZINC49568888

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 35 No

Popular Name: N-[2-[(5E)-5-benzylidene-2,4-dioxo-thiazolidin-3-yl]ethyl]-2-[[(1S)-2-morpholino-1-phenyl-ethyl]amin N-[2-[(5E)-5-benzylidene-2,4-dio…

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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) 2.40 7.89 -45.85 3 8 1 97 495.625 10 ↓
Hi High (pH 8-9.5) 2.40 6.36 -14.71 2 8 0 93 494.617 10 ↓
Lo Low (pH 4.5-6) 2.40 9.71 -129.9 4 8 2 98 496.633 10 ↓
Lo Low (pH 4.5-6) 2.40 8.74 -44.77 3 8 1 94 495.625 10 ↓

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

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