Reaction Details | |||
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Cell Reactant: | Reverse transcriptase (HIV-1 RT)(1-350) | ||
Syringe Reactant: | BDBM1434 | ||
Meas. Tech.: | Enzyme Inhibition | ||
Entry Date: | 06/16/17 | ||
ΔG°: | -30.1±11 (kcal/mole) | ||
pH: | n/a | ||
Log10Kb: | n/a | ||
Temperature: | 298.15±0 (K) | ||
ΔH° : | -47.1± (kcal/mole) | ||
ΔHobs: | n/a | ||
Ionic Strength: | n/a | ||
n/a | |||
Protons Released: | n/a | ||
ΔCp : | n/a | ||
Stoich. Param.: | n/a | ||
ΔS° : | -0.0100±0.0100 (kcal/mole-K) | ||
Comments: | n/a | ||
Citation | Decha, P; Intharathep, P; Udommaneethanakit, T; Sompornpisut, P; Hannongbua, S; Wolschann, P; Parasuk, V Theoretical studies on the molecular basis of HIV-1RT/NNRTIs interactions. J Enzyme Inhib Med Chem26:29-36 (2011) [PubMed] Article | ||
More Info.: | Get all data from this article , ITC RUN data | ||
Reverse transcriptase (HIV-1 RT)(1-350) | |||
Source: | n/a | ||
Purity: | n/a | ||
Prep. Method: | n/a | ||
Name: | Reverse transcriptase (HIV-1 RT)(aa 1-350) | ||
Synonyms: | POL_HV1H2 | gag-pol | ||
Type: | Enzyme | ||
Mol. Mass.: | 39217.95 | ||
Organism: | Human immunodeficiency virus type 1 | ||
Description: | HIV-1 RT variant (1-350 aa) | ||
Residue: | 350 | ||
Sequence: |
| ||
BDBM1434 | |||
Source: | n/a | ||
Purity: | n/a | ||
Prep. Method: | n/a | ||
Name | BDBM1434 | ||
Synonyms: | 11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido[3,2-b:2 ,3 -e][1,4]diazepin-6-one | 2-cyclopropyl-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one | BI-RG-587 | CHEMBL57 | Nevirapine | Nevirapine (NVP) | US11420959, Example NVP | Viramune | ||
Type | Small organic molecule | ||
Emp. Form. | C15H14N4O | ||
Mol. Mass. | 266.2979 | ||
SMILES | Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12 | ||
Structure |
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