UCSF

ZINC01249240

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2004 22 No

Other Names:

MFCD01951834

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) 4.38 10.74 -9.34 1 3 0 38 334.51 1
Hi High (pH 8-9.5) 4.84 10.29 -40.08 0 3 -1 41 333.502 1

Activity (Go SEA)

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