UCSF

ZINC00985156

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 25 No

Other Names:

MFCD01461566

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 5.78 -8.25 3 5 0 88 393.244 2
Lo Low (pH 4.5-6) 3.70 6.01 -57.8 4 5 1 89 394.252 2

Activity (Go SEA)

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