UCSF

ZINC70005788

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2011 27 Yes

Popular Name: 6-[4-(8-quinolylmethyl)piperazin-1-yl]pyrido[2,3-b]pyrazine 6-[4-(8-quinolylmethyl)piperazin…

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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) 2.53 7.37 -15.56 0 6 0 58 356.433 3 ↓
Mid Mid (pH 6-8) 2.53 9.61 -44.09 1 6 1 59 357.441 3 ↓

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

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