UCSF

ZINC32580631

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2009 27 Yes

Download: MOL2 SDF SMILES Flexibase

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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) 5.05 10.81 -15.33 1 5 0 60 382.485 7
Hi High (pH 8-9.5) 5.23 9.76 -47.99 0 5 -1 67 381.477 7

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