UCSF

ZINC12376492

Substance Information

In ZINC since Heavy atoms Benign functionality
May 10th, 2008 31 No

Other Names:

MFCD03034414

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) 4.28 12.21 -11.55 1 5 0 62 433.508 5
Ref Reference (pH 7) 4.28 11.45 -11.27 1 5 0 62 433.508 5

Activity (Go SEA)

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