UCSF

ZINC14016357

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 31 No

Popular Name: benzeneacetic acid, 2-[[[1,5-dioxo-5-(3-phenylpropoxy)pentyl]amino]thioxomethyl]hydrazide benzeneacetic acid, 2-[[[1,5-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) 3.42 12.59 -35.86 3 7 0 97 441.553 14 ↓

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Rings

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

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