UCSF

ZINC16690138

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.41 9.84 -34.75 1 5 0 58 376.551 4
Hi High (pH 8-9.5) 4.41 7.97 -49.15 0 5 -1 56 375.543 4

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