UCSF

ZINC38735728

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 26 No

Download: MOL2 SDF SMILES Flexibase

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) 4.14 10.71 -21.78 1 4 0 47 365.433 4
Lo Low (pH 4.5-6) 4.14 11.15 -36.55 2 4 1 48 366.441 4

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

No pre-computed analogs available. Try a structural similarity search.