UCSF

ZINC13712591

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 31 No

Other Names:

MFCD03031515

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) 6.74 13.36 -54.5 0 6 -1 88 472.329 4
Ref Reference (pH 7) 6.74 12.93 -55.5 0 6 -1 88 472.329 4

Activity (Go SEA)

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