UCSF

ZINC13012010

Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2008 29 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) 4.33 10.05 -49.82 0 5 -1 80 421.269 7
Mid Mid (pH 6-8) 4.33 8.92 -16.46 1 5 0 77 422.277 7

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