UCSF

ZINC00402468

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 18 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) 3.38 7.78 -41.1 0 3 -1 57 243.282 3
Mid Mid (pH 6-8) 2.26 0.71 -9.17 0 3 0 51 244.29 3

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

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