UCSF

ZINC38569903

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 34 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) 5.18 10.47 -33.06 2 6 1 74 450.518 6
Lo Low (pH 4.5-6) 5.18 10.84 -98.45 3 6 2 76 451.526 6

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

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