UCSF

ZINC37839283

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 18 No

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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) 1.69 8.27 -18.35 0 3 0 37 255.264 4
Hi High (pH 8-9.5) 1.70 7.21 -54.3 0 3 -1 43 254.256 4

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Rings

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