UCSF

ZINC55100480

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 25 Yes

Popular Name: 4-methyl-2-[4-(1H-tetrazol-5-yl)-1-piperidyl]-7,8-dihydro-6H-cyclopenta[g]quinoline 4-methyl-2-[4-(1H-tetrazol-5-yl)…

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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) 2.88 9.3 -44.72 1 6 0 70 334.427 2 ↓
Hi High (pH 8-9.5) 2.88 8.99 -45.35 0 6 -1 69 333.419 2 ↓
Mid Mid (pH 6-8) 2.88 9.29 -29.28 2 6 1 72 335.435 2 ↓

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

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