UCSF

ZINC13451116

Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 37 No

CAS Numbers: 1884-24-8 , 30964-13-7 , [30964-13-7]

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) 1.42 1.36 -67.91 6 12 -1 214 515.447 9

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