UCSF

ZINC55002188

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 18 No

Popular Name: N-[[4-methyl-2-(1,4-thiazepan-4-yl)thiazol-5-yl]methyl]cyclopropanamine N-[[4-methyl-2-(1,4-thiazepan-4-…

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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 8.01 -38.09 2 3 1 33 284.474 4 ↓
Hi High (pH 8-9.5) 2.14 6.73 -5.01 1 3 0 28 283.466 4 ↓

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

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