UCSF

ZINC60119674

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2011 43 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) 9.04 18.17 -174.47 7 5 3 87 556.693 3
Hi High (pH 8-9.5) 9.04 18.39 -70.08 6 5 2 86 555.685 3

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

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