UCSF

ZINC44835928

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2010 25 No

Other Names:

MFCD18173374

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) 3.47 7.05 -15.66 1 7 0 94 343.335 7
Hi High (pH 8-9.5) 3.47 7.97 -61.48 0 7 -1 97 342.327 7

Activity (Go SEA)

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