UCSF

ZINC34224353

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 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) 0.29 1.62 -43.81 3 3 1 50 201.677 5
Hi High (pH 8-9.5) 0.29 0.25 -7.95 2 3 0 45 200.669 5

Activity (Go SEA)

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