UCSF

ZINC13553021

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 27 No

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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) 4.88 8.47 -14.51 1 6 0 78 420.947 5
Ref Reference (pH 7) 3.95 8.31 -14.34 1 6 0 75 420.947 6

Activity (Go SEA)

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