UCSF

ZINC45037491

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2010 19 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) -0.09 2.01 -12.31 2 6 0 79 285.369 4
Hi High (pH 8-9.5) 0.10 -0.63 -43.89 1 6 -1 85 284.361 4

Activity (Go SEA)

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