UCSF

ZINC00216575

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Popular Name: Methyl 3-amino-4-(cyclohexylamino)benzoate Methyl 3-amino-4-(cyclohexylamin…

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CAS Numbers: 503859-27-6 , [503859-27-6]

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) 3.95 -1.04 -6.58 3 4 0 64 248.326 4 ↓

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