UCSF

ZINC01580668

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 18 Yes

CAS Number: 37045-14-0

Other Names:

MFCD12877737

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) 3.38 0.9 -9.91 0 2 0 29 233.27 2

Activity (Go SEA)

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