UCSF

ZINC13281632

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 19 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) 3.18 9.93 -11.51 0 2 0 30 249.313 1
Lo Low (pH 4.5-6) 3.18 9.93 -28.62 1 2 1 31 250.321 1

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