UCSF

ZINC39749466

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 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) 3.31 9.11 -23.51 2 10 0 143 413.415 8
Mid Mid (pH 6-8) 3.31 8.91 -53.36 1 10 -1 141 412.407 8

Activity (Go SEA)

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