UCSF

ZINC87492939

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2013 15 Yes

CAS Number: [39924-52-2]

Other Names:

MFCD00189366

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) 2.02 7.18 -6.54 0 3 0 43 208.257 4

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

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