Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 6795-27-3
MolClass #3001
RBDKZGXATKRZKY-UHFFFAOYSA-N
- NOCAS_M153
MolClass #3002
NXUCOCMJAHWYNO-UHFFFAOYSA-N
- 2243-62-1
MolClass #3003
KQSABULTKYLFEV-UHFFFAOYSA-N
- 611-23-4
MolClass #3004
TWLBRQVYXPMCFK-UHFFFAOYSA-N
- 60877-91-0
MolClass #3005
SRTUFACVYMPCPX-UHFFFAOYSA-N
- 835-71-2
MolClass #3006
UTMZWCTVPHAOJZ-UHFFFAOYSA-N
- 14204-98-9
MolClass #3007
VKTBLHRTAVWXIJ-UHFFFAOYSA-N
- 122-80-5
MolClass #3008
CHMBIJAOCISYEW-UHFFFAOYSA-N
- 716-53-0
MolClass #3009
KULLJOPUZUWTMF-UHFFFAOYSA-N
- NOCAS_M295
MolClass #3010
YSUQLAYJZDEMOT-UHFFFAOYSA-N
- 85-98-3
MolClass #3011
PZIMIYVOZBTARW-UHFFFAOYSA-N
- 128-37-0
MolClass #3012
NLZUEZXRPGMBCV-UHFFFAOYSA-N
- 58-19-5
MolClass #3013
IKXILDNPCZPPRV-UHFFFAOYSA-N
- NOCAS_M559
MolClass #3014
BHRZNVHARXXAHW-UHFFFAOYSA-N
- 62573-57-3
MolClass #3015
WUCMRTYSFAJAOS-UHFFFAOYSA-N
- 147974-61-6
MolClass #3016
DYKNUIKMDGBXED-UHFFFAOYSA-N
- 97-18-7
MolClass #3017
JFIOVJDNOJYLKP-UHFFFAOYSA-N
- 25413-64-3
MolClass #3018
SVTBQUKRCVPUHS-UHFFFAOYSA-N
- 116169-87-0
MolClass #3019
DQGMASZUGMDEFA-UHFFFAOYSA-N
- 130536-37-7
MolClass #3020
DUTMSHWTRSUNIF-UHFFFAOYSA-N
- 3688-79-7
MolClass #3021
BGQDCDRDPCVLJE-UHFFFAOYSA-N
- 57-92-1
MolClass #3022
UCSJYZPVAKXKNQ-UHFFFAOYSA-N
- 26093-31-2
MolClass #3023
GLNDAGDHSLMOKX-UHFFFAOYSA-N
- 95331-48-9
MolClass #3024
RPQHVGSJKJADLO-UHFFFAOYSA-N
- 90243-66-6
MolClass #3025
- 3366-61-8
MolClass #3026
DZQXBXZZSKPMDV-UHFFFAOYSA-N
- 151910-75-7
MolClass #3027
YQINXCSNGCDFCQ-UHFFFAOYSA-N
- 132172-57-7
MolClass #3028
PGMRWRQBMDSQPZ-UHFFFAOYSA-N
- NOCAS_M486
MolClass #3029
VJHINFRRDQUWOJ-UHFFFAOYSA-N
- 18024-11-8
MolClass #3030
RHNKXMFRUHICPK-UHFFFAOYSA-N
- 36099-26-0
MolClass #3031
KLLPVNAKBNBWMY-UHFFFAOYSA-N
- 527-17-3
MolClass #3032
WAMKWBHYPYBEJY-UHFFFAOYSA-N
- 106-42-3
MolClass #3033
URLKBWYHVLBVBO-UHFFFAOYSA-N
- 6325-54-8
MolClass #3034
KUEKYPPUOKZVFM-UHFFFAOYSA-N
- 498-02-2
MolClass #3035
DFYRUELUNQRZTB-UHFFFAOYSA-N
- 95-87-4
MolClass #3036
NKTOLZVEWDHZMU-UHFFFAOYSA-N
- 13345-62-5
MolClass #3037
IKWYHKBBMXJHNN-UHFFFAOYSA-N
- 314084-63-4
MolClass #3038
WSRGCUOXXGIVCV-UHFFFAOYSA-N
- 121625-58-9
MolClass #3039
AAWMBIUFIQYVAV-UHFFFAOYSA-N
- 94339-56-7
MolClass #3040
FATJNWZPDDTAJF-UHFFFAOYSA-N
- 71-23-8
MolClass #3041
BDERNNFJNOPAEC-UHFFFAOYSA-N
- 2798-25-6
MolClass #3042
JDIORNFCMMYMLF-UHFFFAOYSA-N
- 16757-81-6
MolClass #3043
PIAGFISXZFTFAL-UHFFFAOYSA-N
- 11042-64-1
MolClass #3044
FODTZLFLDFKIQH-UHFFFAOYSA-N
- 132172-58-8
MolClass #3045
RRFAGUKOFFEOLW-UHFFFAOYSA-N
- 29852-26-4
MolClass #3046
WFAJDSVQAGXSMA-UHFFFAOYSA-N
- 22181-94-8
MolClass #3047
- NOCAS_M412
MolClass #3048
DSZTYVZOIUIIGA-UHFFFAOYSA-N
- 57541-73-8
MolClass #3049
MKHXETBKLZIQOV-UHFFFAOYSA-N
- 67019-20-9
MolClass #3050
KRAHRISRQSSYAG-UHFFFAOYSA-N
- 69686-05-1
MolClass #3051
DTTVUKLWJFJOHO-UHFFFAOYSA-N
- 67-66-3
MolClass #3052
HEDRZPFGACZZDS-UHFFFAOYSA-N
- 142713-63-1
MolClass #3053
PUWQCNGWBKXWCX-UHFFFAOYSA-N
- 477-30-5
MolClass #3054
NNJPGOLRFBJNIW-UHFFFAOYSA-N
- 118-74-1
MolClass #3055
CKAPSXZOOQJIBF-UHFFFAOYSA-N
- 67587-52-4
MolClass #3056
NIRHEGBBHNJANV-UHFFFAOYSA-N
- 6943-00-6
MolClass #3057
MQCXNSWYTPALRY-UHFFFAOYSA-N
- 220168-45-6
MolClass #3058
CUYGAWYEFLAINT-UHFFFAOYSA-N
- 10087-89-5
MolClass #3059
NBEALWAVEGMZQY-UHFFFAOYSA-N
- 10387-13-0
MolClass #3060
UOSROERWQJTVNU-UHFFFAOYSA-N
- 55380-34-2
MolClass #3061
JIWAGFGPBKDFQN-UHFFFAOYSA-N
- 111955-22-7
MolClass #3062
- 327-97-9
MolClass #3063
CWVRJTMFETXNAD-UHFFFAOYSA-N
- 133960-22-2
MolClass #3064
KZGSRIGHCWCKHH-UHFFFAOYSA-N
- 50-00-0
MolClass #3065
WSFSSNUMVMOOMR-UHFFFAOYSA-N
- 56222-35-6
MolClass #3066
XDZKGLWJXJTZJZ-UHFFFAOYSA-N
- 132-27-4
MolClass #3067
LLEMOWNGBBNAJR-UHFFFAOYSA-N
- 18172-33-3
MolClass #3068
- 24930-41-4
MolClass #3069
NLJSQHIKRZBLKI-UHFFFAOYSA-N
- 52021-61-1
MolClass #3070
YTGNIIJMSNZCOG-UHFFFAOYSA-N
- 116-31-4
MolClass #3071
NCYCYZXNIZJOKI-UHFFFAOYSA-N
- 115655-93-1
MolClass #3072
NTVZQKWOVUUDMC-UHFFFAOYSA-N
- 43047-59-2
MolClass #3073
DYVZJYYJUNOBHR-UHFFFAOYSA-N
- 94-45-1
MolClass #3074
KOYJWFGMEBETBU-UHFFFAOYSA-N
- 1260-17-9
MolClass #3075
DGQLVPJVXFOQEV-UHFFFAOYSA-N
- 1918-00-9
MolClass #3076
IWEDIXLBFLAXBO-UHFFFAOYSA-N
- 56980-94-0
MolClass #3077
NDSFAFIRRXLJNE-UHFFFAOYSA-N
- 16423-68-0
MolClass #3078
OALHHIHQOFIMEF-UHFFFAOYSA-N
- 1468-95-7
MolClass #3079
JCJNNHDZTLRSGN-UHFFFAOYSA-N
- 75-75-2
MolClass #3080
AFVFQIVMOAPDHO-UHFFFAOYSA-N
- 2050-92-2
MolClass #3081
JACMPVXHEARCBO-UHFFFAOYSA-N
- 23043-62-1
MolClass #3082
FCXMXTMQASDIDU-UHFFFAOYSA-N
- 7790-98-9
MolClass #3083
VLTRZXGMWDSKGL-UHFFFAOYSA-N
- 98-55-5
MolClass #3084
WUOACPNHFRMFPN-UHFFFAOYSA-N
- 2226-96-2
MolClass #3085
CSGAUKGQUCHWDP-UHFFFAOYSA-N
- 126370-99-8
MolClass #3086
WZFNBCNLDVGFHH-UHFFFAOYSA-N
- 154-41-6
MolClass #3087
DLNKOYKMWOXYQA-UHFFFAOYSA-N
- 106-23-0
MolClass #3088
NEHNMFOYXAPHSD-UHFFFAOYSA-N
- 73936-27-3
MolClass #3089
XHUCGUZYMJDQMH-UHFFFAOYSA-N
- 117-84-0
MolClass #3090
MQIUGAXCHLFZKX-UHFFFAOYSA-N
- 17924-92-4
MolClass #3091
MBMQEIFVQACCCH-UHFFFAOYSA-N
- 135-51-3
MolClass #3092
USWINTIHFQKJTR-UHFFFAOYSA-N
- 139953-78-9
MolClass #3093
JBHJPSXXEJFSRP-UHFFFAOYSA-N
- 2746-81-8
MolClass #3094
LRWSFOSWNAQHHW-UHFFFAOYSA-N
- 86831-65-4
MolClass #3095
GYEBVHSGJPHJRP-UHFFFAOYSA-N
- 6287-38-3
MolClass #3096
ZWUSBSHBFFPRNE-UHFFFAOYSA-N
- 16339-07-4
MolClass #3097
CEAIOKFZXJMDAS-UHFFFAOYSA-N
- 34049-50-8
MolClass #3098
DSLLNRXGDQGJJM-UHFFFAOYSA-N
- 94-81-5
MolClass #3099
LLWADFLAOKUBDR-UHFFFAOYSA-N
- 110-80-5
MolClass #3100
ZNQVEEAIQZEUHB-UHFFFAOYSA-N