UCSF

ZINC15015616

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 26 No

Other Names:

MFCD01920217

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) 6.53 7.23 -43.08 0 5 -1 70 492.172 1
Ref Reference (pH 7) 6.53 7.92 -41.43 0 5 -1 70 492.172 1
Mid Mid (pH 6-8) 6.07 9.06 -8.2 1 5 0 67 493.18 1
Mid Mid (pH 6-8) 6.07 9.49 -7.9 1 5 0 67 493.18 1

Activity (Go SEA)

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