UCSF

ZINC71257006

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2011 8 No

CAS Number: 1121-91-1

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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) 0.31 -0.8 -4.1 2 2 0 38 130.216 0
Lo Low (pH 4.5-6) 0.31 -0.45 -43.1 3 2 1 40 131.224 0

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

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