UCSF

ZINC05376284

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) 5.96 9.96 -7.8 1 3 0 45 322.433 3
Mid Mid (pH 6-8) 5.47 10.21 -43.65 0 3 -1 44 321.425 4
Lo Low (pH 4.5-6) 5.47 10.57 -13.04 1 3 0 42 322.433 4

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