UCSF

ZINC41537263

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 33 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) 3.71 11.34 -64.61 1 7 0 87 452.551 9
Lo Low (pH 4.5-6) 3.71 10.58 -42.65 2 7 1 84 453.559 9

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