UCSF

ZINC95869670

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 27 No

Other Names:

MFCD00057075

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) -3.38 -4.89 -313.15 2 15 -4 233 423.171 6
Mid Mid (pH 6-8) -3.38 -6.05 -183.14 3 15 -3 230 424.179 6

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

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