UCSF

ZINC40232478

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2010 29 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) 6.44 13.4 -10.02 0 4 0 36 406.913 7
Lo Low (pH 4.5-6) 6.44 14.06 -33.13 1 4 1 38 407.921 7

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

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