UCSF

ZINC24843687

Substance Information

In ZINC since Heavy atoms Benign functionality
January 21st, 2009 24 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) 2.59 10.55 -43.53 1 4 1 42 323.416 5
Mid Mid (pH 6-8) 2.59 8.75 -10.22 0 4 0 41 322.408 5
Mid Mid (pH 6-8) 2.59 8.75 -10.19 0 4 0 41 322.408 5

Activity (Go SEA)

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