UCSF

ZINC00711762

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 28 Yes

Other Names:

MFCD00344225

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) 4.43 -4.72 -16.88 2 6 0 84 461.337 6
Hi High (pH 8-9.5) 4.43 -4.14 -49.49 1 6 -1 86 460.329 6

Activity (Go SEA)

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