UCSF

ZINC48940272

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 19 No

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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) 0.91 1.05 -9.43 3 7 0 100 328.101 3
Mid Mid (pH 6-8) 0.91 1.03 -36.65 2 7 -1 98 327.093 3

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

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