UCSF

ZINC32192705

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 12 Yes

Other Names:

MFCD11870746

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) 2.84 6.21 -5.61 0 1 0 13 157.216 1
Mid Mid (pH 6-8) 2.84 6.61 -29.03 1 1 1 14 158.224 1

Activity (Go SEA)

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