UCSF

ZINC26729789

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2009 15 Yes

Other Names:

MFCD27959780

N/A

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) 0.16 -0.11 -55.54 4 4 1 66 210.253 1
Hi High (pH 8-9.5) 0.16 -0.43 -8.53 3 4 0 65 209.245 1

Activity (Go SEA)

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