UCSF

ZINC22748279

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 30 No

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Annotations

Vendors

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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) 2.53 7.23 -20.76 3 8 0 128 490.335 8
Hi High (pH 8-9.5) 2.53 7.25 -42.94 2 8 -1 125 489.327 8

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

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