UCSF

ZINC00119624

Annotations

Vendors

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) 1.36 3.17 -11.61 0 4 0 52 203.197 2

Vendor Notes

Note Type Comments Provided By
MP 102 TCI
purity 9.500000000000000e+001 Enamine Building Blocks
Mp [°C] 94 - 100 Acros Organics
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Fluorochem
MP 98 - 100 Enamine Building Blocks
MP 98...100 Enamine Building Blocks
H phrase H318: Causes serious eye damage Acros Organics
H phrase H318: Causes serious eye damage; H315: Causes skin irritation; H335: May cause respiratory irritation; H341: Suspected of causing genetic defects Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P262: Do not get in eyes, on skin, or on clothing; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water fo Acros Organics
R phrase R41: Risk of serious damage to eyes. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S39: Wear eye/face protection. Acros Organics
Hazard XI: Irritant Acros Organics

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.