UCSF

ZINC31921969

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 20 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) 1.42 6.75 -20.02 2 4 0 56 282.372 3
Lo Low (pH 4.5-6) 1.42 7.16 -35.22 3 4 1 57 283.38 3

Activity (Go SEA)

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