UCSF

ZINC31891608

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 13 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) 1.09 5.28 -92.88 4 2 2 32 204.383 5
Hi High (pH 8-9.5) 1.09 3.31 -44.11 3 2 1 31 203.375 5

Activity (Go SEA)

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