UCSF

ZINC11535796

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 10 No

CAS Number: 28128-15-6

Other Names:

MFCD11870168

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) 0.95 -2.85 -15.11 1 4 0 54 199.011 0
Mid Mid (pH 6-8) 0.95 -2.59 -45.71 2 4 1 56 200.019 0

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

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