UCSF

ZINC33870996

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2009 34 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) 5.23 12.29 -37.04 3 6 1 75 477.654 6
Mid Mid (pH 6-8) 5.23 11.87 -17.38 2 6 0 74 476.646 6

Activity (Go SEA)

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