UCSF

ZINC65356209

Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2011 24 No

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Annotations

None

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) 3.71 2.57 -40.71 3 6 1 88 324.36 4
Mid Mid (pH 6-8) 3.71 3.44 -118.22 4 6 2 90 325.368 4

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

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