UCSF

ZINC00608603

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2005 19 Yes

Other Names:

MFCD04127665

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) 2.07 5.12 -46.94 1 5 -1 86 284.357 7
Lo Low (pH 4.5-6) 2.07 3.14 -12.36 2 5 0 83 285.365 7

Activity (Go SEA)

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