UCSF

ZINC69927182

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 31 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) 3.00 7.89 -19.78 2 7 0 88 419.481 6
Mid Mid (pH 6-8) 3.18 6.2 -56.55 1 7 -1 94 418.473 6

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

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