UCSF

ZINC06580549

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2006 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) -1.31 1.1 -170.88 11 8 3 158 408.567 15
Mid Mid (pH 6-8) -1.31 0.77 -104.76 10 8 2 157 407.559 15

Activity (Go SEA)

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