UCSF

ZINC40189600

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 25 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) 3.41 9.25 -13.09 1 6 0 73 345.443 9
Lo Low (pH 4.5-6) 3.41 9.74 -34.57 2 6 1 74 346.451 9

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