UCSF

ZINC58314527

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 25 Yes

Popular Name: N-[(2S)-2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]tetrazolo[5,1-f]pyridazin-6-amine N-[(2S)-2-(3-methoxyphenyl)-2-py…

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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) 2.14 7.01 -52.43 2 8 1 82 340.411 6 ↓
Hi High (pH 8-9.5) 2.14 4.28 -16.73 1 8 0 80 339.403 6 ↓

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

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