UCSF

ZINC01532722

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 13 Yes

Download: MOL2 SDF SMILES Flexibase

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) -4.29 -5.34 -100.36 6 6 0 135 190.199 6

Vendor Notes

Note Type Comments Provided By
Mp [°C] 300 Acros Organics
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Melting_Point >300? Alfa-Aesar
Melting_Point >300° Alfa-Aesar
UniProt Database Links AK1_BACSU; ALD1_ARATH; ALD1_ORYSJ; ARGD_BUCAI; ARGD_BUCAP; ARGD_ECO57; ARGD_ECOL6; ARGD_ECOLI; ARGD_PHOLL; ARGD_SALTI; ARGD_SALTY; ARGD_SHIFL; ARGD_YERPE; DAPAT_ACAM1; DAPAT_AQUAE; DAPAT_ARATH; DAPAT_AZOPC; DAPAT_BACFN; DAPAT_BACFR; DAPAT_BACTN; DAPAT_BAC ChEBI
UniProt Database Links DAPDH_BACFN; DAPDH_CLOTH; DAPDH_CORGL; DAPDH_LYSSH; DAPDH_URETH; DAPF1_NOSS1; DAPF2_NOSS1; DAPF_ACAM1; DAPF_ACIAC; DAPF_ACIAD; DAPF_ACIB3; DAPF_ACIB5; DAPF_ACIBC; DAPF_ACIBS; DAPF_ACIBT; DAPF_ACIBY; DAPF_ACIC1; DAPF_ACICJ; DAPF_ACIET; DAPF_ACTP2; DAPF_ACT ChEBI
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Hazard XI: Irritant Acros Organics

Activity (Go SEA)

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