UCSF

ZINC04635154

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2005 32 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) 2.03 -3.2 -54.86 4 8 1 120 459.906 10
Mid Mid (pH 6-8) 1.45 -0.94 -60.43 3 8 1 117 459.906 10

Activity (Go SEA)

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