UCSF

ZINC27644186

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2009 34 No

CAS Number: 11079-53-1

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Annotations

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Vendors

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) 6.83 14.5 -33.89 0 4 -1 74 467.67 9
Mid Mid (pH 6-8) 6.25 14.5 -7.44 0 4 0 68 468.678 9

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