UCSF

ZINC13563449

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 30 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) 5.17 15.4 -46.94 2 2 1 16 397.586 5
Mid Mid (pH 6-8) 5.17 13.77 -35.06 2 2 1 20 397.586 5
Mid Mid (pH 6-8) 5.17 13.04 -3.55 1 2 0 15 396.578 5

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