UCSF

ZINC01375892

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 38 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) 3.81 10.57 -10.75 1 9 0 98 528.638 10
Lo Low (pH 4.5-6) 3.81 11.14 -52.68 2 9 1 99 529.646 10

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

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