UCSF

ZINC19313536

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2008 27 No

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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) 3.24 9.32 -11.26 0 5 0 44 404.297 3
Ref Reference (pH 7) 3.24 9.3 -10.58 0 5 0 44 404.297 3
Mid Mid (pH 6-8) 3.24 11.47 -54.04 1 5 1 45 405.305 3

Activity (Go SEA)

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