UCSF

ZINC69923995

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 22 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) 1.37 3.9 -16.31 1 4 0 49 326.437 4
Mid Mid (pH 6-8) 1.37 5.7 -54.62 2 4 1 51 327.445 4

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

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