UCSF

ZINC00607915

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 33 Yes

CAS Number: 24428-71-5

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) 3.86 -3.89 -20.04 2 8 0 110 488.997 9
Hi High (pH 8-9.5) 3.86 -3.32 -58.72 1 8 -1 112 487.989 9

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

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