UCSF

ZINC48977414

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 20 Yes

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Vendors

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) -0.16 -1.37 -44.04 1 8 -1 107 279.276 3
Lo Low (pH 4.5-6) -0.61 0.48 -13.05 2 8 0 104 280.284 3

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

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