UCSF

ZINC33784390

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2009 33 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) 3.42 11.76 -13.85 1 7 0 65 467.591 12
Lo Low (pH 4.5-6) 3.42 12.23 -52.21 2 7 1 66 468.599 12

Activity (Go SEA)

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