UCSF

ZINC32108353

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2009 18 Yes

Download: MOL2 SDF SMILES Flexibase

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) 1.57 3.85 -44.17 3 4 1 57 255.382 3
Hi High (pH 8-9.5) 1.57 2.59 -8.86 2 4 0 53 254.374 3

Activity (Go SEA)

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