UCSF

ZINC57997819

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2011 21 Yes

Popular Name: N-[(4-chlorophenyl)methyl]-1-(4-phenylthiazol-2-yl)methanamine N-[(4-chlorophenyl)methyl]-1-(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) 3.91 8.25 -6.88 1 2 0 25 314.841 5 ↓
Mid Mid (pH 6-8) 3.91 9.62 -49.69 2 2 1 29 315.849 5 ↓

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

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