UCSF

ZINC49381668

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 35 Yes

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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) 4.87 14.35 -17.7 0 6 0 47 489.019 6
Lo Low (pH 4.5-6) 4.87 15.94 -50.82 1 6 1 48 490.027 6

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

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