UCSF

ZINC01530011

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 19 Yes

CAS Numbers: 104215-84-1 , 29411-63-0 , 50-29-3

Other Names:

1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-chlorobenzene); 1,1'-(2,2,2-trichloroethylidene)bis[4-chlorobenzene]; 1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane; 1,1,1-Trichloro-2,2-bis-(4'-chlorophenyl)ethane; 1,1-bis(4-chlorophenyl)-2,2,2-trichloroethane

1,1'-(2,2,2-Trichloroethane-1,1-diyl)bis(4-chlorobenzene);1,1'-(2,2,2-Trichloroethylidene)bis(4-chloro)-Benzene;1,1'-(2,2,2-Trichloroethylidene)bis(4-chlorobenzene), 9CI;1,1,1-Trichloro-2,2-bis(4,4'-dichlorodiphenyl)ethane;1,1,1-Trichloro-2,2-bis(4-chloro

1,1'-(2,2,2-Trichloroethylidene)bis(4-chlorobenzene); 1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-chlorobenzene); 1,1'-(2,2,2-trichloroethylidene)bis[4-chlorobenzene]; 1,1,1-Trichloor-2,2-bis(4-chloor fenyl)-ethaan [Dutch]; 1,1,1-Trichlor-2,2-bis(4-chlor-p

1,1'-(2,2,2-trichloroethylidene)bis[4-chlorobenzene]; 1,1,1-trichloro-2,2-bis(4-chlorophenyl)ethane; 1,1-bis(4-chlorophenyl)-2,2,2-trichloroethane; 4,4'-DDT; alpha,alpha-bis(p-chlorophenyl)-beta,beta,beta-trichlorethane; clofenotane; dichlorodiphenyltrich

1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane; 1,1,1-Trichloro-2,2-bis-(4'-chlorophenyl)ethane; 50-29-3; C04623; Clofenotane; DDT; Dichlorodiphenyltrichloroethane

1,1,1-trichloro-2,2-bis(4-chlorophenyl)ethane; 50-29-3; CPD-43; DDT

1,1,1-TRICHLORO-2,2-BIS-[4-CHLOROPHENYL]ETHANE-RING-UL-14C

4,4'-(2,2,2-Trichloroethane-1,1-diyl)bis(chlorobenzene)

4,4'-DDT

4,4'-Dichlorodiphenyltrichloroethane

50-29-3; Chlorophenothane; Clofenotane (INN); D07367

BRD-K51799616-001-02-2

CCRIS 1312; DDT-technical; LS-194123

CHEBI:472; CHEBI:18849; CHEBI:11129

Chlorophenothane (NF); Clofenotane (INN); Dicophane (BAN)

Clofenotane

DDT-Dimethoate; DDT-Rogor mixture; Dimethoate-DDT; Ethane, 1,1,1-trichloro-2,2-bis(p-chlorophenyl)-, compd. with phosphorodithioic acid O,O-dimethyl ester, S-ester with 2-mercapto-N-methyl acetamide; LS-66150; Vantal

dichlorodiphenyltrichloroethane

MFCD00000802

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) 6.71 11.46 -3.03 0 0 0 0 354.491 3

Vendor Notes

Note Type Comments Provided By
UniProt Database Links CCD1D_DROME; CCD1P_DROME; CP6G1_DROME; CP6G2_DROME; GST1C_ANOGA; GST1D_ANOGA; GSTT1_DROER; GSTT1_DROMA; GSTT1_DROME; GSTT1_DROSE; GSTT1_DROSI; GSTT1_DROTE; NU301_CAEEL; NU301_DROME; RSF1_HUMAN; SODC_NICPL; UB2D3_BOVIN; UB2D3_HUMAN; UB2D3_MACFA; UB2D3_MOUS ChEBI
Patent Database Links EP1844793 ChEBI
Therapy insecticide SMDC MicroSource

Activity (Go SEA)

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

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