UCSF

ZINC41535707

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 27 No

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Annotations

Vendors

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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) 1.33 7.95 -75.94 2 7 0 94 371.437 6
Lo Low (pH 4.5-6) 1.33 7.06 -47.83 3 7 1 91 372.445 6

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