UCSF

ZINC59816177

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 35 No

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Annotations

Vendors

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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) 3.14 10.53 -65.83 1 9 -1 127 535.645 10
Mid Mid (pH 6-8) 3.14 11.42 -121.47 0 9 -2 129 534.637 10

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

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