UCSF

ZINC00702947

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 34 No

Other Names:

MFCD04147947

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) 4.71 -0.23 -11.46 1 7 0 100 492.94 5
Mid Mid (pH 6-8) 4.12 -0.39 -12.05 0 7 0 97 492.94 5

Activity (Go SEA)

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