UCSF

ZINC01398541

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 17 Yes

Other Names:

MFCD04125963

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) 1.83 8.82 -8.81 0 4 0 44 250.685 4
Mid Mid (pH 6-8) 1.83 9.33 -36.64 1 4 1 45 251.693 4

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

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