UCSF

ZINC49340595

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 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) 1.18 1.53 -12.51 2 7 0 104 266.253 4
Mid Mid (pH 6-8) 1.18 2.29 -32.84 1 7 -1 107 265.245 4

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

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