UCSF

ZINC05288134

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2006 21 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) 2.56 1.52 -11.51 3 6 0 90 283.287 3
Hi High (pH 8-9.5) 2.56 2.29 -47.26 2 6 -1 93 282.279 3
Lo Low (pH 4.5-6) 2.56 2 -12.55 4 6 0 92 284.295 3

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