UCSF

ZINC04403397

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2005 11 No

CAS Numbers: 2438-80-4 , 3615-37-0 , 3615-41-6 , 634-74-2 , 7658-08-4

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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) -1.64 -6.17 -10.02 4 5 0 97 164.157 4

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