KEGG   DRUG: D03371Help
Entry
D03371                      Drug                                   

Name
Capravirine (USAN/INN)
Formula
C20H20Cl2N4O2S
Exact mass
450.0684
Mol weight
451.3694
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antiviral [reverse transcriptase inhibitor]
Comment
nonnucleoside reverse transcriptase inhibitor (NNRTI)
Target
RNA-directed DNA polymerase inhibitor [KO:K00986]
Interaction
Drug interaction
Other DBs
CAS: 
178979-85-6
PubChem: 
PDB-CCD: 
LigandBox: 
KCF data Show

ATOM        29
            1   C8y C    22.7249  -16.3578
            2   C8y C    24.1290  -16.3578
            3   N4y N    24.5629  -15.0224
            4   C8y C    23.4270  -14.1970
            5   N5x N    22.2911  -15.0224
            6   C1b C    23.4270  -12.7773
            7   C1b C    25.7663  -14.3218
            8   O7a O    22.1990  -12.0683
            9   C8y C    25.7640  -12.9075
            10  C8x C    26.9535  -12.2177
            11  C8x C    26.9509  -10.8145
            12  N5x N    25.7344  -10.1152
            13  C8x C    24.5448  -10.8049
            14  C8x C    24.5474  -12.2081
            15  C1c C    22.0249  -17.5702
            16  C1a C    22.7249  -18.7826
            17  S2a S    24.8290  -17.5702
            18  C1a C    20.6500  -17.5702
            19  C8y C    26.2500  -17.5702
            20  C7a C    20.9923  -12.7649
            21  N1a N    19.7750  -12.0622
            22  O6a O    20.9924  -14.1400
            23  C8x C    26.9499  -18.7825
            24  C8y C    28.3499  -18.7825
            25  C8x C    29.0499  -17.5701
            26  C8y C    28.3500  -16.3578
            27  C8x C    26.9500  -16.3578
            28  X   Cl   29.0405  -15.1621
            29  X   Cl   29.0403  -19.9780
BOND        31
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     1   5 1
            6     4   6 1
            7     3   7 1
            8     6   8 1
            9     7   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15    9  14 1
            16    1  15 1
            17   15  16 1
            18    2  17 1
            19   15  18 1
            20   17  19 1
            21    8  20 1
            22   20  21 1
            23   20  22 2
            24   19  23 2
            25   23  24 1
            26   24  25 2
            27   25  26 1
            28   26  27 2
            29   19  27 1
            30   26  28 1
            31   24  29 1

» Japanese version   » Back

DBGET integrated database retrieval system