UCSF

ZINC02170876

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 12 Yes

CAS Number: 42370-07-0

Other Names:

MFCD00216984

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) 2.66 6.5 -2.87 0 1 0 17 166.264 1

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