UCSF

ZINC22307237

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2008 19 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) -2.72 7.04 -36.98 0 4 1 30 261.345 4
Mid Mid (pH 6-8) -2.72 9.56 -109.97 1 4 2 31 262.353 4

Activity (Go SEA)

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