UCSF

ZINC05520069

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2006 27 Yes

Other Names:

MFCD02046463

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) 3.70 7.16 -15.81 2 7 0 89 384.461 7
Hi High (pH 8-9.5) 3.70 7.02 -53.82 1 7 -1 87 383.453 7

Activity (Go SEA)

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