UCSF

ZINC03901268

Substance Information

In ZINC since Heavy atoms Benign functionality
October 17th, 2005 20 Yes

Other Names:

MFCD00981552

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) 2.67 5.71 -12.19 1 5 0 64 292.36 6
Mid Mid (pH 6-8) 3.13 3.72 -52.28 0 5 -1 67 291.352 6

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

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