UCSF

ZINC05019192

Substance Information

In ZINC since Heavy atoms Benign functionality
January 16th, 2006 11 No

CAS Number: 21661-97-2

Other Names:

MFCD00015571

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) 3.83 2.59 -5.23 0 1 0 17 154.253 7

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