UCSF

ZINC00639783

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 23 Yes

Other Names:

MFCD04091504

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) 4.41 -3.17 -12.5 1 5 0 64 376.261 5
Hi High (pH 8-9.5) 4.41 -2.6 -47.04 0 5 -1 66 375.253 5

Activity (Go SEA)

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