UCSF

ZINC62035152

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 19 No

Popular Name: 4-[[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]methyl]thiadiazol-5-amine 4-[[4-(pyrrolidin-1-ylmethyl)-1-…

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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) 1.38 5.77 -99.99 4 5 2 61 283.445 4 ↓
Mid Mid (pH 6-8) 1.38 3.5 -40.2 3 5 1 59 282.437 4 ↓

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

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