UCSF

ZINC95865051

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 0 Yes

CAS Numbers: 129-51-1 , 60-79-7

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

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

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