UCSF

ZINC38570443

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 32 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) 3.06 6.73 -19.26 4 7 0 90 450.564 5
Mid Mid (pH 6-8) 3.06 7.74 -52.41 5 7 1 94 451.572 5

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

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