UCSF

ZINC44277036

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 22 Yes

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) 2.34 8.53 -86.37 4 5 2 50 308.47 8
Hi High (pH 8-9.5) 2.34 5.47 -40.27 3 5 1 49 307.462 8

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