UCSF

ZINC00665833

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 25 Yes

Other Names:

MFCD04149432

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) 2.59 2.65 -16.87 1 7 0 93 384.479 7
Mid Mid (pH 6-8) 2.59 2.77 -51.72 0 7 -1 95 383.471 7

Activity (Go SEA)

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