UCSF

ZINC15894634

Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2008 26 No

Other Names:

MFCD04092182

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) 3.03 6.65 -21.39 0 5 0 67 386.498 2
Ref Reference (pH 7) 3.03 7.85 -21.88 0 5 0 67 386.498 2
Lo Low (pH 4.5-6) 3.03 8.16 -38.81 1 5 1 68 387.506 2

Activity (Go SEA)

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