UCSF

ZINC31995690

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 21 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) 2.60 6.01 -53.05 3 6 1 92 289.311 5
Hi High (pH 8-9.5) 2.60 5.61 -12.75 2 6 0 90 288.303 5

Activity (Go SEA)

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