UCSF

ZINC69485150

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 22 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) 0.52 1.43 -54.13 1 7 1 81 331.462 7
Mid Mid (pH 6-8) 0.52 1.38 -47.52 1 7 1 81 331.462 7
Mid Mid (pH 6-8) 0.52 -0.85 -16.97 0 7 0 80 330.454 7

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

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