UCSF

ZINC63938241

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 23 No

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Annotations

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Vendors

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) 1.87 2.54 -49.11 3 8 1 114 338.413 5
Hi High (pH 8-9.5) 1.87 2.83 -36.89 2 8 0 116 337.405 5

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

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