UCSF

ZINC31943516

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 23 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) 3.59 9.31 -20.82 2 3 0 44 331.391 3
Lo Low (pH 4.5-6) 3.59 9.72 -38.05 3 3 1 45 332.399 3

Activity (Go SEA)

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