UCSF

ZINC32009361

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 14 Yes

Other Names:

MFCD11935547

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) -0.20 2.75 -45 3 4 1 61 197.258 4
Mid Mid (pH 6-8) -0.20 2.35 -9.25 2 4 0 59 196.25 4

Activity (Go SEA)

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