UCSF

ZINC34614680

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 18 Yes

Other Names:

MFCD08694097

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) 1.70 5 -43.55 1 4 1 42 267.374 2
Mid Mid (pH 6-8) 1.70 2.53 -9.43 0 4 0 41 266.366 2

Activity (Go SEA)

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