UCSF

ZINC36878960

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 20 Yes

Other Names:

MFCD25458241

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) 1.38 6.08 -52.59 2 6 1 72 287.38 7
Hi High (pH 8-9.5) 1.38 4.9 -8.73 1 6 0 68 286.372 7

Activity (Go SEA)

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