UCSF

ZINC05376289

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2006 23 No

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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) 5.10 7.78 -10.38 1 4 0 54 324.405 3
Mid Mid (pH 6-8) 4.61 7.68 -47.83 0 4 -1 53 323.397 4
Lo Low (pH 4.5-6) 4.61 8.47 -12.76 1 4 0 51 324.405 4

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