UCSF

ZINC70117149

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2011 19 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) 1.19 3.54 -9.18 4 6 0 93 263.345 3
Lo Low (pH 4.5-6) 1.19 3.77 -32.2 5 6 1 94 264.353 3

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

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