UCSF

ZINC02473647

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 14 Yes

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) -0.10 -1.7 -38.01 1 7 -1 108 198.158 4
Mid Mid (pH 6-8) -0.56 -0.13 -8.78 2 7 0 105 199.166 4

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

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