UCSF

ZINC01794885

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 31 Yes

Popular Name: 3-allyl-2-(benzylsulfanyl)-5,6-dihydrospiro(benzo[h]quinazoline-5,1'-cyclohexane)-4(3H)-one 3-allyl-2-(benzylsulfanyl)-5,6-d…

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Other Names:

MFCD01175037

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) 6.45 1.71 -8.31 1 0 0 34 428.601 3 ↓

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