UCSF

ZINC39886216

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 25 No

Download: MOL2 SDF SMILES Flexibase

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) 2.75 3.14 -14.52 3 6 0 105 377.422 3
Mid Mid (pH 6-8) 3.21 1.59 -43.98 2 6 -1 108 376.414 3

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