UCSF

ZINC60184603

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2011 40 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) -5.46 -16.65 -146.23 20 19 3 347 586.62 9
Mid Mid (pH 6-8) -5.46 -18.05 -95.81 19 19 2 343 585.612 9

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

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