UCSF

ZINC00001523

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 13 Yes

CAS Numbers: 1463-28-1 , 23389-32-4

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) 0.40 -3.1 -95.03 6 4 2 68 184.287 4

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