UCSF

ZINC31977449

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 23 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) 1.75 6.97 -89.19 2 6 0 77 317.389 6
Mid Mid (pH 6-8) 1.75 4.6 -63.65 1 6 -1 76 316.381 6

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