UCSF

ZINC40659948

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2010 24 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) 2.42 10.76 -10.23 2 9 0 113 327.348 5
Lo Low (pH 4.5-6) 2.42 11.24 -25.3 3 9 1 115 328.356 5

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

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