UCSF

ZINC00421644

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 14 Yes

Popular Name: 3-(hydroxymethyl)-6-methyl-2(1H)-quinolinone 3-(hydroxymethyl)-6-methyl-2(1H)…

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CAS Numbers: 485337-96-0 , N/A

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) 0.85 1.71 -8.56 2 3 0 53 189.214 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 194 Sublimes KeyOrganics
MP 194SUB° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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