UCSF

ZINC00073639

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Other Names:

MFCD00452489

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) 3.37 9.24 -11 0 2 0 17 208.264 1
Mid Mid (pH 6-8) 3.37 9.69 -25.76 1 2 1 19 209.272 1

Activity (Go SEA)

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