UCSF

ZINC61365370

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 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) 3.93 9.61 -7.21 0 2 0 18 290.819 4
Mid Mid (pH 6-8) 3.93 10.19 -28.86 1 2 1 19 291.827 4

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

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