UCSF

ZINC43212294

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 29 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) 1.28 8.95 -34.03 2 7 0 103 402.491 7
Hi High (pH 8-9.5) 1.28 8.24 -51.94 1 7 -1 99 401.483 7

Activity (Go SEA)

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