UCSF

ZINC19262567

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 14 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) 1.08 3.91 -40.85 4 3 1 53 189.238 3
Mid Mid (pH 6-8) 1.08 4.52 -37.36 4 3 1 56 189.238 3
Mid Mid (pH 6-8) 1.08 4.09 -4.74 3 3 0 51 188.23 3

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

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