UCSF

ZINC40018715

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2010 34 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) 6.74 15.25 -71.86 1 5 0 65 523.526 13
Lo Low (pH 4.5-6) 6.74 14.49 -52.81 2 5 1 62 524.534 13

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