UCSF

ZINC95869757

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 10 No

CAS Numbers: 136-85-6 , 29878-31-7

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) 1.39 1.14 -8.54 0 3 0 37 133.154 0

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