UCSF

ZINC36634403

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 21 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) -1.65 1.99 -47.52 2 9 1 98 318.379 3
Mid Mid (pH 6-8) -1.65 -0.37 -15.98 1 9 0 97 317.371 3

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

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