UCSF

ZINC32606623

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 31 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) -0.43 8.27 -106.08 3 8 0 121 421.384 5
Hi High (pH 8-9.5) 0.87 7.85 -118.82 2 8 -1 124 420.376 5

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