UCSF

ZINC62035176

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 20 No

Popular Name: [4-[[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]methyl]thiadiazol-5-yl]hydrazine [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) 1.15 5.56 -100.19 5 6 2 73 298.46 5 ↓
Mid Mid (pH 6-8) 1.15 3.3 -40.51 4 6 1 72 297.452 5 ↓
Lo Low (pH 4.5-6) 1.15 5.39 -191.59 6 6 3 74 299.468 5 ↓

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

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