UCSF

ZINC32606388

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 28 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) 0.41 4.48 -56.25 3 7 0 108 401.419 6
Hi High (pH 8-9.5) 1.71 4.07 -55.67 2 7 -1 111 400.411 6

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