UCSF

ZINC40046532

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 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) 2.73 7.27 -65.82 1 8 -1 112 442.488 12
Mid Mid (pH 6-8) 2.73 6.36 -18.85 2 8 0 109 443.496 12

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