UCSF

ZINC01004789

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 15 Yes

Popular Name: 1'h-spiro[cyclopentane-1,2'-quinazolin]-4'(3'h)-one 1'h-spiro[cyclopentane-1,2'-quin…

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CAS Numbers: , 1135-80-4 , N/A , Unregistered , [1135-80-4]

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) 2.26 3.44 -9.14 2 3 0 41 202.257 0 ↓
Ref Reference (pH 7) 2.33 0.34 -5.16 2 3 0 45 202.257 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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