UCSF

ZINC07718853

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2006 23 Yes

CAS Number: 873813-37-7

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) 2.59 0.21 -13.3 0 7 0 83 312.281 3

Activity (Go SEA)

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