UCSF

ZINC39894875

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 19 Yes

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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) -2.21 4.01 -130.17 1 7 -2 121 263.205 4
Lo Low (pH 4.5-6) -2.21 2.02 -62.26 2 7 -1 118 264.213 4
Lo Low (pH 4.5-6) -2.21 1.91 -55.49 2 7 -1 118 264.213 4

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