UCSF

ZINC07645000

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2006 25 Yes

Popular Name: 3-[(4-benzothiazol-2-yl-1-piperidyl)carbonyl]benzonitrile 3-[(4-benzothiazol-2-yl-1-piperi…

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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) 2.80 0.15 -13.93 0 4 0 56 347.443 2 ↓

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