UCSF

ZINC49277220

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 20 No

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Annotations

Vendors

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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) 2.26 1.5 -9.75 3 6 0 87 281.356 5
Hi High (pH 8-9.5) 2.45 -1.15 -41.06 2 6 -1 94 280.348 5

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

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