UCSF

ZINC09160288

Substance Information

In ZINC since Heavy atoms Benign functionality
August 10th, 2007 34 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) 2.94 9.52 -48.57 2 7 1 84 464.586 8
Mid Mid (pH 6-8) 2.36 10.19 -57.96 1 7 1 81 464.586 8

Activity (Go SEA)

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