UCSF

ZINC38223053

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2010 32 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) 3.61 12.97 -14.89 2 8 0 90 433.512 6
Mid Mid (pH 6-8) 3.79 13.48 -56.56 3 8 1 95 434.52 6

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