UCSF

ZINC71530569

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 25 No

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Annotations

None

Vendors

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) 2.66 4.61 -55.01 1 7 -1 103 397.889 8
Lo Low (pH 4.5-6) 2.66 4.75 -24.09 2 7 0 101 398.897 8

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

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