UCSF

ZINC32138649

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 21 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) -1.54 -1.56 -50.01 4 10 -1 159 316.234 6
Lo Low (pH 4.5-6) -1.54 -1.14 -37.94 5 10 0 161 317.242 6

Activity (Go SEA)

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