UCSF

ZINC12955602

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 11 Yes

Popular Name: 3-Bromo-5,6,7,8-tetrahydro-1,6-naphthyridine 3-Bromo-5,6,7,8-tetrahydro-1,6-n…

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CAS Numbers: 1159010-96-4 , 1187932-53-1 , 1990-05-1 , 625100-00-7 , [625100-00-7]

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) 1.66 1.94 -4.25 1 2 0 25 213.078 0 ↓
Lo Low (pH 4.5-6) 1.66 3.62 -102.54 3 2 2 31 215.094 0 ↓

Vendor Notes

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

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.