UCSF

ZINC66447240

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 21 No

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Annotations

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Vendors

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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) 0.97 5.37 -13.55 0 7 0 54 331.467 5
Lo Low (pH 4.5-6) 0.97 5.5 -40.16 1 7 1 55 332.475 5

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

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