UCSF

ZINC40232829

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2010 22 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) 4.99 10.67 -11.57 0 3 0 27 377.669 5
Lo Low (pH 4.5-6) 4.99 11.34 -27.56 1 3 1 28 378.677 5

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

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