UCSF

ZINC48783450

Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2010 19 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) 0.32 -3.44 -12.07 3 8 0 109 264.241 4
Hi High (pH 8-9.5) 0.51 -6.08 -42.84 2 8 -1 116 263.233 4

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

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