UCSF

ZINC44455895

Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2010 28 Yes

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Annotations

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) 2.13 3.85 -14.35 1 8 0 80 393.484 8
Mid Mid (pH 6-8) 2.13 6.05 -54.04 2 8 1 82 394.492 8

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