UCSF

ZINC52952853

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2010 25 No

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Annotations

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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) 1.73 8.1 -59.12 2 7 1 89 367.495 8
Hi High (pH 8-9.5) 1.73 5.94 -21.89 1 7 0 88 366.487 8

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

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