UCSF

ZINC08896401

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2007 37 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) 3.87 11.7 -57.33 2 8 1 90 511.639 13
Mid Mid (pH 6-8) 3.29 12.36 -68.31 1 8 1 87 511.639 13

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