UCSF

ZINC36192188

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 16 Yes

Other Names:

MFCD14590969

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) 0.07 4.01 -93 4 4 2 52 229.368 3
Hi High (pH 8-9.5) 0.07 3.69 -42.43 3 4 1 51 228.36 3

Activity (Go SEA)

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