UCSF

ZINC06660877

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2006 22 Yes

Popular Name: Cinchonidine Cinchonidine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 24302-67-8 , 485-71-2

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) 3.03 -1.41 -38.37 2 3 1 37 295.406 3 ↓
Lo Low (pH 4.5-6) 3.03 -1.31 -94.59 3 3 2 38 296.414 3 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 200 - 203 Acros Organics
Melting_Point 201-206? Alfa-Aesar
Melting_Point 201-206° Alfa-Aesar
Target Antifection Selleck Chemicals
H phrase H302: Harmful if swallowed Acros Organics
H phrase H302: Harmful if swallowed; H332: Harmful if inhaled; H312: Harmful in contact with skin Acros Organics
Target Others Selleck Chemicals
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; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P304 + P340: IF INHALED: R Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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