UCSF

ZINC60021293

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 32 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) -0.54 3.52 -94.08 5 10 0 163 493.592 8
Mid Mid (pH 6-8) -0.54 3.12 -67.77 4 10 -1 162 492.584 8

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

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