UCSF

ZINC32229319

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 23 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.77 5.34 -9.46 2 4 0 50 313.376 3
Mid Mid (pH 6-8) 1.77 7.67 -49.97 3 4 1 51 314.384 3

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