UCSF

ZINC69505043

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 17 Yes

Popular Name: (R)-8-quinolyl(1H-tetrazol-5-yl)methanamine (R)-8-quinolyl(1H-tetrazol-5-yl)…

Find On: PubMed — Wikipedia — Google

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) 0.28 1.31 -43.99 3 6 0 93 226.243 2 ↓
Mid Mid (pH 6-8) 0.28 0.97 -45.22 2 6 -1 92 225.235 2 ↓
Mid Mid (pH 6-8) 0.28 1.31 -44.74 4 6 1 95 227.251 2 ↓
Mid Mid (pH 6-8) 0.28 1.12 -10.27 3 6 0 93 226.243 2 ↓

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

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