UCSF

ZINC39917180

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 27 Yes

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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) 4.74 11.02 -44.96 1 4 1 26 404.365 4
Mid Mid (pH 6-8) 4.74 10.82 -42.36 1 4 1 26 404.365 4
Mid Mid (pH 6-8) 4.74 8.66 -10.28 0 4 0 24 403.357 4
Lo Low (pH 4.5-6) 4.74 11.97 -93.4 2 4 2 27 405.373 4

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