UCSF

ZINC95707523

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2014 9 Yes

CAS Number: 272-49-1

Other Names:

MFCD00971977

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) 1.24 2.67 -9.46 0 2 0 25 118.139 0

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

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