UCSF

ZINC38574017

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 22 No

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Annotations

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Vendors

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) 3.70 8.81 -28.83 2 3 1 29 288.374 1
Lo Low (pH 4.5-6) 3.70 8.95 -93.04 3 3 2 34 289.382 1

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

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