e-Drug3D

199

CHLORAMBUCIL

INN
CHLORAMBUCIL

cas 305-03-3

CLASS

ANTINEOPLASTIC
ALKYLATING

ROUTE (list)

ORAL

ATC code

L01AA02

PK parameters

Tmax 0.83 HOUR
VD 20.15 LITER (65 KILOGRAM)
Cl 10.9 LITER / HOUR (65 KILOGRAM)
PPB 99 PERCENT
t1/2 1.3 HOUR

Target

TARGET DNA

PDB
3CSJ (HUMAN GLUTATHIONE S-TRANSFERASE P1-1 IN COMPLEX WITH CHLORAMBUCIL)

Download experimental 3D coordinates of CBL with added hydrogens

Unknown

Download SDF file

4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid

Formula:
C14H19Cl2NO2

Calculated chemical properties:

MW 303.19
NB_atoms 19
XLogP 2.04
PSA 38.193
NB_HD 0
NB_HA 3
fsp3 0.50
Lipinski(0=no;1=yes) 1

FDA
NDA 010669 (label) INN (CHLORAMBUCIL) LEUKERAN (WAYLIS THERAP) APPROVAL= AP YEAR= 1957