UCSF

ZINC61481191

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 15 No

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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) 2.71 8.79 -4.54 0 2 0 16 224.735 4
Mid Mid (pH 6-8) 2.71 9.26 -29.45 1 2 1 17 225.743 4

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

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