UCSF

ZINC49510874

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 21 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) 2.02 6.62 -6.59 0 4 0 34 312.841 5
Mid Mid (pH 6-8) 2.02 8.63 -46.3 1 4 1 36 313.849 5

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

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