UCSF

ZINC65330821

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 34 Yes

Popular Name: 8-chloro-7-methoxy-N-[3-[4-(1-piperidyl)-1-piperidyl]propyl]thieno[2,3-b]quinoline-2-carboxamide 8-chloro-7-methoxy-N-[3-[4-(1-pi…

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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) 4.93 9.92 -51.37 2 6 1 59 502.104 7 ↓
Mid Mid (pH 6-8) 4.93 12.12 -116.45 3 6 2 60 503.112 7 ↓
Mid Mid (pH 6-8) 4.93 9.87 -44.56 2 6 1 59 502.104 7 ↓

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Rings

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

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