UCSF

ZINC40061151

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 28 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) 3.86 9.05 -16.17 0 4 0 46 407.461 5
Lo Low (pH 4.5-6) 3.86 11.4 -48.36 1 4 1 47 408.469 5

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