UCSF

ZINC12405113

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2008 27 No

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Annotations

None

Vendors

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) -4.37 -14.75 -20.87 8 16 0 222 388.297 6
Mid Mid (pH 6-8) -4.23 -17.39 -49.99 7 16 -1 228 387.289 6

Activity (Go SEA)

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