UCSF

ZINC03063796

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 27 Yes

Popular Name: 3-(3,4-dichlorophenyl)-5-piperidino[1,2,4]triazolo[4,3-c]quinazoline 3-(3,4-dichlorophenyl)-5-piperid…

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CAS Number: 338977-96-1

Other Names:

MFCD00141540

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) 5.90 2.06 -8.28 0 5 0 46 398.297 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 204 - 206 KeyOrganics

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