UCSF

ZINC69738921

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 21 Yes

Popular Name: 6-[(3S)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]tetrazolo[5,1-f]pyridazine 6-[(3S)-3-ethyl-4-(2-methoxyethy…

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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) 1.08 5.21 -55.38 1 8 1 73 292.367 5 ↓
Mid Mid (pH 6-8) 1.08 2.96 -15.49 0 8 0 72 291.359 5 ↓

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

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