UCSF

ZINC41823118

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2010 19 No

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Annotations

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) -0.57 1.02 -20.56 2 8 0 105 266.257 4
Mid Mid (pH 6-8) -0.38 -1.6 -51.56 1 8 -1 111 265.249 4

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

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