UCSF

ZINC39272652

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 26 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) 2.99 3.85 -11.34 0 7 0 86 345.362 3
Lo Low (pH 4.5-6) 2.99 4.3 -44.58 1 7 1 87 346.37 3

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

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