UCSF

ZINC12503113

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 27 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) -2.47 -5.25 -128.16 5 14 -2 229 423.215 6
Mid Mid (pH 6-8) -2.47 -4 -250.94 4 14 -3 232 422.207 6

Activity (Go SEA)

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