UCSF

ZINC07209221

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2006 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.28 4.38 -16.47 2 6 0 81 362.451 5
Mid Mid (pH 6-8) 3.28 3.72 -41.94 1 6 -1 83 361.443 5

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