UCSF

ZINC22699595

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 19 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) 1.51 1.99 -36.48 1 5 -1 78 260.248 3
Lo Low (pH 4.5-6) 1.06 2.81 -10.78 2 5 0 75 261.256 3

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

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