UCSF

ZINC38740020

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 22 Yes

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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) 1.38 2.61 -17.24 2 7 0 97 319.39 7
Hi High (pH 8-9.5) 1.45 1.08 -56.76 1 7 -1 103 318.382 7

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

No pre-computed analogs available. Try a structural similarity search.