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tsca_cdk.csv

Metadata

Name Value Last Modified
md5
  • md5: e54f26b4d94711540830e456e7544a4f
  • sha1: c75f4f878784f23bfb794dc07bbea8b1f191ce09
  • sha224: a65bd1749e4b7c428240002f58ba7238f5db955c0ed41913e8c6e088
  • sha256: 3261a26edee0f326f2599904b324baa991955fa152efd2197a72f2e8369afbf4
  • sha384: 601adc5a3a967ac6f3a2b343a00dca7a6c142038e9ac8c6fbbf3ad599f2a2767d5812df0111a51f28a1c93306d6333f2
  • sha512: 91e63e1e0fe4f3ddfbc7f25b03b09ceafcbf6bba52508cd6a9e4037e099fa6e10106e64541ea73464e38f535e6ab7cfac8bfe7b4478818e8548ccaa5012d5cf7
Extracted by http://clowder:9000/api/extractors/ncsa.file.digest on Sep 14, 2022
csv_headers
  • csv_headers:
    • row ID
    • Mannhold LogP
    • Atomic Polarizabilities
    • Aromatic Atoms Count
    • Aromatic Bonds Count
    • Element Count
    • Bond Polarizabilities
    • Bond Count
    • Eccentric Connectivity Index
    • Fragment Complexity
    • VABC Volume Descriptor
    • Hydrogen Bond Acceptors
    • Hydrogen Bond Donors
    • Largest Chain
    • Largest Pi Chain
    • Petitjean Number
    • Rotatable Bonds Count
    • Lipinski's Rule of Five
    • Topological Polar Surface Area
    • Vertex adjacency information magnitude
    • Molecular Weight
    • XLogP
    • Zagreb Index
    • Formal Charge
    • Formal Charge (pos)
    • Formal Charge (neg)
    • Heavy Atoms Count
    • Molar Mass
    • SP3 Character
    • Rotatable Bonds Count (non terminal)
Extracted by ncsa.csvheaders on Sep 14, 2022
  • md5: e54f26b4d94711540830e456e7544a4f
  • sha1: c75f4f878784f23bfb794dc07bbea8b1f191ce09
  • sha224: a65bd1749e4b7c428240002f58ba7238f5db955c0ed41913e8c6e088
  • sha256: 3261a26edee0f326f2599904b324baa991955fa152efd2197a72f2e8369afbf4
  • sha384: 601adc5a3a967ac6f3a2b343a00dca7a6c142038e9ac8c6fbbf3ad599f2a2767d5812df0111a51f28a1c93306d6333f2
  • sha512: 91e63e1e0fe4f3ddfbc7f25b03b09ceafcbf6bba52508cd6a9e4037e099fa6e10106e64541ea73464e38f535e6ab7cfac8bfe7b4478818e8548ccaa5012d5cf7
  • csv_headers:
    • row ID
    • Mannhold LogP
    • Atomic Polarizabilities
    • Aromatic Atoms Count
    • Aromatic Bonds Count
    • Element Count
    • Bond Polarizabilities
    • Bond Count
    • Eccentric Connectivity Index
    • Fragment Complexity
    • VABC Volume Descriptor
    • Hydrogen Bond Acceptors
    • Hydrogen Bond Donors
    • Largest Chain
    • Largest Pi Chain
    • Petitjean Number
    • Rotatable Bonds Count
    • Lipinski's Rule of Five
    • Topological Polar Surface Area
    • Vertex adjacency information magnitude
    • Molecular Weight
    • XLogP
    • Zagreb Index
    • Formal Charge
    • Formal Charge (pos)
    • Formal Charge (neg)
    • Heavy Atoms Count
    • Molar Mass
    • SP3 Character
    • Rotatable Bonds Count (non terminal)
Extractor Started Latest Update Latest Status
Submission Status
Timestamp Status Message
Wed Sep 14 13:47:10 GMT 2022 SUBMITTED (Cancel submission)
Wed Sep 14 13:47:12 GMT 2022 START: Started processing.
Wed Sep 14 13:47:12 GMT 2022 PROCESS: Uploading file metadata.
Wed Sep 14 13:47:12 GMT 2022 DONE
Submission Status
Timestamp Status Message
Wed Sep 14 13:47:10 GMT 2022 SUBMITTED (Cancel submission)
Wed Sep 14 13:47:11 GMT 2022 START: Started processing.
Wed Sep 14 13:47:11 GMT 2022 PROCESS: Downloading file.
Wed Sep 14 13:47:11 GMT 2022 PROCESS: Uploading file metadata.
Wed Sep 14 13:47:11 GMT 2022 DONE
Submission Status
Timestamp Status Message
Wed Sep 14 13:47:10 GMT 2022 SUBMITTED (Cancel submission)
Type:text/csv
File size:2.2 MB
Uploaded on: Sep 14, 2022 13:47:10
Uploaded as: tsca_cdk.csv
Uploaded by: Katie Paul-Friedman
Access: Public
Status: PROCESSED

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Views: 58
Last viewed: Jun 16, 2025 19:59:52
Downloads: 14
Last downloaded: Dec 27, 2024 13:15:43

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Type: blank
Holder: blank

Dataset containing the file

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