UCSF

ZINC00227132

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

Popular Name: 1-Phenyl-1,2-dihydroisoquinolin-3(4H)-one 1-Phenyl-1,2-dihydroisoquinolin-…

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CAS Numbers: 17507-05-0 , [17507-05-0]

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) 2.59 6.73 -7.94 1 2 0 29 223.275 1 ↓

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