UCSF

ZINC02512234

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 18 Yes

CAS Number: 30269-04-6

Other Names:

MFCD00142575

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) 3.75 -2.17 -10.64 4 2 0 52 232.286 0

Vendor Notes

Note Type Comments Provided By
MP 180 TCI

Activity (Go SEA)

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