UCSF

ZINC72201425

Substance Information

In ZINC since Heavy atoms Benign functionality
May 5th, 2012 12 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) -1.32 0.3 -12.7 2 4 0 69 193.268 6
Mid Mid (pH 6-8) -1.32 0.62 -58.26 3 4 1 71 194.276 6

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

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